data_1p68_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 1p68 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.439 ' HA2' ' HB3' ' A' ' 48' ' ' MET . . . . . . . . 0 N--CA 1.45 -0.421 0 N-CA-C 112.788 -0.125 . . . . 0.0 112.788 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.0 tptt -62.97 -17.42 62.04 Favored 'General case' 0 CA--C 1.513 -0.455 0 O-C-N 122.809 -0.23 . . . . 0.0 111.327 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.88 -23.43 7.07 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.005 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 39.4 p-10 -61.25 -39.69 91.27 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.851 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -50.13 -29.61 9.48 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.079 0.466 . . . . 0.0 110.185 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -87.66 -29.35 21.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.281 179.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.1 mt -67.74 -35.54 78.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.563 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -51.78 -47.8 64.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.664 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -49.16 -46.29 45.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.26 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.466 ' HG ' ' N ' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -55.46 -58.71 6.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.762 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.466 ' N ' ' HG ' ' A' ' 12' ' ' LEU . 40.2 tt0 -55.16 -37.73 67.37 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.336 -179.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -76.41 -26.46 55.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.87 0.367 . . . . 0.0 110.175 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.508 ' CG2' ' HA ' ' A' ' 85' ' ' ILE . 0.5 OUTLIER -69.87 -27.28 32.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.345 179.31 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.46 HD21 ' HA ' ' A' ' 13' ' ' GLN . 2.7 mm? -62.63 -40.39 96.83 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.179 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -41.24 -39.74 1.43 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.069 0.462 . . . . 0.0 110.54 179.519 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -70.7 -47.04 61.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.528 178.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.578 ' HG ' HD12 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -47.67 -40.81 20.88 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.392 179.806 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.535 ' CE1' ' CD1' ' A' ' 30' ' ' LEU . 63.5 m-70 -52.48 -39.29 61.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.908 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.525 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 3.9 mmpt? -86.88 5.07 38.7 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -177.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.1 m-20 -152.97 19.93 0.58 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.745 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.653 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 0.8 OUTLIER -84.84 -31.17 23.95 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.645 179.156 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.475 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 84.6 t60 -178.44 -52.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.541 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.23 -87.0 0.3 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.94 -0.647 . . . . 0.0 111.827 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -136.15 -145.52 5.07 Favored Glycine 0 N--CA 1.442 -0.931 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.605 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.416 ' HD2' ' CE1' ' A' ' 20' ' ' HIS . 1.2 ttpt -94.1 -20.88 19.5 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.603 0.24 . . . . 0.0 111.339 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -52.29 -53.85 38.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.557 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -79.41 -27.21 41.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.317 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.653 ' HB2' ' CD1' ' A' ' 23' ' ' TRP . 2.1 tm? -75.24 -29.28 60.18 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.408 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.1 OUTLIER -49.05 -38.29 23.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.653 179.909 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -75.91 -23.57 55.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.715 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.482 HG11 ' CG1' ' A' ' 67' ' ' VAL . 0.9 OUTLIER -87.26 -58.16 3.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.831 179.764 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.49 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -59.32 -24.23 63.14 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.898 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.412 ' O ' ' HB2' ' A' ' 39' ' ' ASN . 1.0 OUTLIER -56.67 -44.3 81.28 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 177.816 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -57.82 -49.61 76.08 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 177.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.479 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -57.4 -66.64 0.43 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.591 178.536 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.415 ' O ' HG22 ' A' ' 41' ' ' ILE . 0.3 OUTLIER -46.46 -41.99 14.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.684 -179.59 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 35' ' ' ASN . 2.1 t-20 -68.52 -26.02 65.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.875 0.369 . . . . 0.0 110.615 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.45 ' O ' HG13 ' A' ' 44' ' ' ILE . 53.8 t -77.32 -37.71 25.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.525 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.415 HG22 ' O ' ' A' ' 38' ' ' GLN . 4.8 tp -48.17 -37.31 7.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 120.995 0.426 . . . . 0.0 110.664 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -75.67 -41.21 54.47 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.699 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -60.53 -30.23 69.62 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 40' ' ' VAL . 4.0 mt -86.54 -41.93 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.886 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 25.8 m170 -62.44 -43.97 97.54 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.273 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -73.89 -11.22 60.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.076 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.48 ' CD1' ' C ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -85.43 -42.03 14.87 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.76 179.781 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.439 ' HB3' ' HA2' ' A' ' 3' ' ' GLY . 1.6 tpp -45.73 -27.74 0.88 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.925 -179.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.86 19.96 10.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.788 0.328 . . . . 0.0 111.763 -179.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 75.85 33.16 51.79 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.644 -0.788 . . . . 0.0 113.121 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -95.19 40.24 2.71 Favored Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 109.961 -1.255 . . . . 0.0 109.961 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 123.11 21.29 2.59 Favored Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 114.503 -0.849 . . . . 0.0 111.015 -178.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.442 ' HA ' ' CD1' ' A' ' 47' ' ' PHE . 33.4 p -61.36 166.09 4.17 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.088 0.471 . . . . 0.0 111.433 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 51.36 51.38 37.1 Favored Glycine 0 N--CA 1.452 -0.284 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.909 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.403 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . 171.61 -33.83 0.14 Allowed Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.288 -0.958 . . . . 0.0 113.192 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.579 ' HD3' ' N ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -88.41 -26.19 22.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.874 0.337 . . . . 0.0 111.689 -179.491 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.579 ' N ' ' HD3' ' A' ' 56' ' ' LYS . 19.7 tp -70.12 -8.14 47.2 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.575 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' A' ' 55' ' ' GLY . 17.3 pt20 -86.39 -49.88 7.31 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.924 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.4 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 3.8 mt-10 -86.88 -34.1 19.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.447 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.457 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 8.7 tpp -74.22 -29.51 61.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.551 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.508 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 5.9 ttm -56.06 -50.74 70.12 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.978 0.418 . . . . 0.0 110.138 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -59.52 -20.87 58.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.824 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.83 -33.2 68.28 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.043 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.469 ' CE2' ' HG3' ' A' ' 61' ' ' MET . 1.1 p90 -84.08 -25.81 29.5 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 120.983 0.42 . . . . 0.0 110.068 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -35.33 27.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.256 178.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.08 -32.44 61.95 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.445 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.482 ' CG1' HG11 ' A' ' 33' ' ' VAL . 96.3 t -58.84 -38.74 74.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.005 179.154 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.517 ' CD2' HG13 ' A' ' 85' ' ' ILE . 0.7 OUTLIER -78.62 -4.33 48.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.233 178.453 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -76.41 -56.74 4.35 Favored 'General case' 0 CA--C 1.521 -0.14 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.597 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 3.1 tp10 -54.02 -36.62 63.2 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.99 0.9 . . . . 0.0 108.674 177.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.578 HD12 ' HG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -74.73 -69.64 0.45 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 113.553 -1.658 . . . . 0.0 112.168 -179.223 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -50.16 -26.14 4.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.633 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -87.27 7.82 26.86 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.428 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.499 ' O ' ' N ' ' A' ' 76' ' ' GLN . 5.7 m-70 -155.38 34.51 0.37 Allowed 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.456 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -51.23 90.34 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.105 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.029 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.499 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -65.64 68.3 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.536 -177.965 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 57.45 29.67 60.87 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.646 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -136.86 46.14 1.04 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.476 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.456 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.7 OUTLIER -52.67 -38.99 61.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.751 0.31 . . . . 0.0 111.224 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -49.58 -32.45 12.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.568 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.533 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.2 m -69.03 -74.16 0.13 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.505 ' HA ' HG12 ' A' ' 85' ' ' ILE . 22.6 t -49.46 -39.19 13.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.914 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.465 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.3 OUTLIER -49.02 -41.51 34.97 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 179.234 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -76.43 -28.92 56.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.694 178.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.533 HG22 ' O ' ' A' ' 81' ' ' THR . 0.2 OUTLIER -85.57 -33.41 7.68 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.346 -179.579 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.502 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -74.43 -43.06 57.91 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 179.115 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -62.49 -29.33 70.46 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -82.92 -57.05 3.47 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.443 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.48 ' O ' ' HB ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -63.51 -51.15 74.15 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.347 -179.675 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.426 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 5.8 mmtp -59.15 -27.53 65.73 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.119 -0.632 . . . . 0.0 109.782 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -90.72 -2.22 57.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.146 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.529 ' O ' ' HG ' ' A' ' 96' ' ' LEU . 0.9 OUTLIER -78.44 -46.62 25.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.339 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.639 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -52.5 -27.56 16.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.41 178.927 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.639 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.2 OUTLIER -65.16 -64.06 0.95 Allowed 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.661 -179.586 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -11.51 10.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.993 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 24.7 mt -89.34 -65.39 1.02 Allowed 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 120.949 0.404 . . . . 0.0 110.587 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.404 ' N ' HD23 ' A' ' 57' ' ' LEU . 25.4 tt0 -64.16 -14.24 53.78 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.176 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 11.2 tt0 -83.33 -24.87 31.94 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.524 179.488 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 31.4 tp -70.82 -61.48 1.75 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.744 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 22.7 t -65.56 -31.58 54.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.137 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -100.46 32.8 2.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.99 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.915 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.863 -0.095 . . . . 0.0 112.863 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.7 tptm -63.8 -15.62 59.2 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.705 0.252 . . . . 0.0 111.232 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.522 ' HG ' HD11 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -54.17 -22.15 10.59 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.861 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.449 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 20.5 p-10 -54.41 -45.24 72.92 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.649 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.16 -33.63 19.68 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.296 0.57 . . . . 0.0 109.539 178.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.406 ' HB3' HD13 ' A' ' 5' ' ' LEU . 1.7 tm? -87.85 -30.46 20.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.01 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.456 ' HG ' HD21 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -65.89 -38.09 87.84 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.082 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -50.51 -40.76 52.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.229 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -47.07 -42.17 18.28 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.075 0.464 . . . . 0.0 110.485 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.486 ' O ' HG13 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -57.31 -61.14 2.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.268 179.234 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.472 ' HA ' HD23 ' A' ' 16' ' ' LEU . 1.1 tm0? -50.63 -38.49 46.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.054 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.81 -31.04 61.6 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.486 HG13 ' O ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -64.97 -29.85 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.735 178.85 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.553 HD11 HD12 ' A' ' 19' ' ' LEU . 3.2 mm? -63.84 -28.43 69.85 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.092 178.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.493 ' HA ' ' HD1' ' A' ' 20' ' ' HIS . 0.2 OUTLIER -48.95 -40.97 32.41 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-O 121.155 0.502 . . . . 0.0 110.041 179.364 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -72.41 -45.67 58.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.79 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.57 HD11 ' HB2' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -43.93 -49.25 8.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.592 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.501 ' CD2' ' CD1' ' A' ' 30' ' ' LEU . 43.9 m80 -45.79 -39.38 8.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.098 -179.328 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.453 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 4.3 mmpt? -91.17 6.62 44.36 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -177.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.42 ' HB2' ' CG2' ' A' ' 81' ' ' THR . 3.0 m-80 -146.5 10.84 1.11 Allowed 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.497 -0.481 . . . . 0.0 112.279 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.62 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -82.07 -35.31 28.8 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.789 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.45 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 85.7 t60 -179.13 -51.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.009 0.433 . . . . 0.0 110.726 179.518 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -134.59 -93.72 0.47 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.903 -0.665 . . . . 0.0 111.747 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -129.13 -148.03 6.5 Favored Glycine 0 N--CA 1.44 -1.081 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.42 ' HD3' ' CE1' ' A' ' 31' ' ' HIS . 7.9 ttmt -94.35 -15.72 24.13 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.626 0.25 . . . . 0.0 111.476 179.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -55.91 -52.28 64.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.862 0.363 . . . . 0.0 111.027 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -81.97 -28.57 32.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.598 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.62 ' HB2' ' CD1' ' A' ' 23' ' ' TRP . 1.4 tm? -70.59 -32.24 69.54 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 178.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.42 ' CE1' ' HD3' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -44.51 -55.12 5.36 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.051 179.904 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -20.41 62.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.117 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.492 ' CG1' ' CG1' ' A' ' 67' ' ' VAL . 1.0 OUTLIER -90.01 -60.25 2.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.716 179.799 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.498 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -62.88 -25.62 68.39 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.182 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.412 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 10.8 t-20 -54.7 -37.72 66.15 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 177.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.15 -49.61 66.81 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.475 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -53.09 -67.74 0.23 Allowed 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.824 178.595 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -46.25 -43.18 15.32 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.262 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -63.73 -24.09 67.63 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.761 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.484 ' O ' HG13 ' A' ' 44' ' ' ILE . 50.8 t -70.55 -56.02 12.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.695 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.445 HG13 ' NE2' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -44.27 -39.75 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.965 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.445 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 3.3 pt-20 -71.15 -32.37 68.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.342 . . . . 0.0 110.404 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.557 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -79.04 -27.04 43.12 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.766 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 40' ' ' VAL . 20.6 mt -86.92 -26.11 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.109 178.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.445 ' NE2' HG13 ' A' ' 41' ' ' ILE . 20.3 m170 -77.88 -57.5 3.77 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.865 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.28 -25.66 67.25 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.072 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.557 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.9 m-85 -88.98 -28.13 20.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.665 179.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.9 ttt -49.46 -28.56 5.43 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.583 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -29.62 43.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.063 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 129.85 -6.3 6.13 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.905 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.45 -29.78 7.66 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.144 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.437 ' HA3' ' CE2' ' A' ' 47' ' ' PHE . . . -157.73 23.0 0.41 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.287 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.5 p -59.97 165.5 3.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.815 0.341 . . . . 0.0 110.543 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 66.46 51.13 44.97 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.531 -0.842 . . . . 0.0 111.995 -179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 161.19 -24.07 0.24 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.42 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.456 ' O ' ' CB ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -84.27 -43.19 15.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.682 0.277 . . . . 0.0 111.134 179.854 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.533 ' O ' ' CB ' ' A' ' 61' ' ' MET . 14.3 tp -65.21 -9.66 25.3 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -86.44 -50.34 6.95 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.793 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -87.33 -31.73 20.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.894 0.378 . . . . 0.0 110.594 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.456 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -78.19 -28.01 48.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.089 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.533 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.5 OUTLIER -59.32 -41.45 89.09 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.071 179.656 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -71.15 -15.73 62.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.083 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.415 ' HB3' HG21 ' A' ' 40' ' ' VAL . 0.9 OUTLIER -80.96 -25.93 36.99 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.273 -179.81 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.496 ' CD1' ' C ' ' A' ' 64' ' ' PHE . 1.2 p90 -86.91 -33.82 19.59 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 121.03 0.443 . . . . 0.0 110.039 179.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.455 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 10.5 tt0 -79.14 -35.67 41.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.731 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.6 tp60 -54.06 -33.5 57.63 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.969 0.414 . . . . 0.0 110.477 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.492 ' CG1' ' CG1' ' A' ' 33' ' ' VAL . 71.8 t -59.41 -39.5 79.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.217 179.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.57 ' HG ' HD22 ' A' ' 71' ' ' LEU . 0.5 OUTLIER -76.19 -5.67 47.82 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.394 178.68 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -75.68 -56.87 4.27 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.468 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 0.5 OUTLIER -53.57 -38.12 63.58 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 122.143 0.973 . . . . 0.0 108.674 177.594 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.57 HD22 ' HG ' ' A' ' 68' ' ' LEU . 0.3 OUTLIER -72.41 -67.36 0.56 Allowed 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 113.434 -1.712 . . . . 0.0 111.848 -179.345 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.408 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 65.9 t30 -51.04 -26.08 5.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.508 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -88.11 9.38 22.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.367 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.502 ' O ' ' N ' ' A' ' 76' ' ' GLN . 73.0 m-70 -154.97 32.31 0.4 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 111.768 0.284 . . . . 0.0 111.768 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.465 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -52.67 88.31 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.086 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.502 ' N ' ' O ' ' A' ' 74' ' ' HIS . 1.2 mm-40 -67.97 69.7 0.13 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.441 . . . . 0.0 111.171 -178.281 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 60.88 21.57 58.88 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.584 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -121.94 39.41 2.33 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.312 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.465 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -49.26 -40.65 35.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.866 0.365 . . . . 0.0 111.469 -179.767 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 1.9 m170 -55.43 -33.9 63.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.58 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.608 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.3 m -67.45 -74.41 0.12 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.511 ' CG1' ' CD2' ' A' ' 71' ' ' LEU . 39.7 t -51.12 -40.73 22.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.083 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.483 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 56.6 t-80 -49.84 -40.88 43.75 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -76.54 -28.35 56.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.635 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.608 HG22 ' O ' ' A' ' 81' ' ' THR . 0.2 OUTLIER -85.3 -33.13 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.962 -179.589 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.506 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.2 OUTLIER -74.38 -46.53 39.82 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.851 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.35 -30.28 66.61 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.403 ' O ' ' CD1' ' A' ' 92' ' ' ILE . 2.5 m-80 -82.75 -68.15 0.73 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.335 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.485 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -50.53 -45.76 26.47 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.473 -179.761 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.2 mmmm -62.53 -30.21 71.12 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.734 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -90.75 -2.32 57.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.278 178.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.44 ' HB ' ' O ' ' A' ' 89' ' ' ILE . 1.1 mp -78.68 -35.63 18.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.634 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -65.37 -30.81 71.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.506 179.177 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.634 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.1 OUTLIER -59.88 -57.09 14.38 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.318 -179.207 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -69.81 -9.96 56.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.387 178.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.456 HD21 ' HG ' ' A' ' 9' ' ' LEU . 35.5 mt -89.43 -54.24 4.18 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.456 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -62.97 -13.15 31.36 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 177.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.43 ' O ' ' CB ' ' A' ' 102' ' ' ARG . 0.1 OUTLIER -80.75 -1.3 42.22 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.836 179.383 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.522 HD11 ' HG ' ' A' ' 5' ' ' LEU . 4.1 mt -96.1 -67.2 0.86 Allowed 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.127 0.489 . . . . 0.0 110.597 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 41.3 t -59.78 -27.45 38.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.946 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -86.91 -33.08 19.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.107 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.43 ' CB ' ' O ' ' A' ' 98' ' ' GLU . 38.2 ttp180 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.952 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.471 ' HA2' ' HG3' ' A' ' 48' ' ' MET . . . . . . . . 0 N--CA 1.45 -0.381 0 N-CA-C 112.609 -0.196 . . . . 0.0 112.609 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.7 tptt -55.87 -19.55 12.25 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.54 0.17 . . . . 0.0 111.241 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.439 ' CD2' HD11 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -49.65 -23.51 1.76 Allowed 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.35 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -58.42 -42.74 87.9 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.742 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -48.81 -30.6 5.91 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.273 0.558 . . . . 0.0 109.752 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -83.64 -35.58 24.49 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.933 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.406 ' O ' HD21 ' A' ' 12' ' ' LEU . 7.9 mt -62.23 -40.95 97.87 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.82 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -49.0 -44.26 40.99 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.683 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -49.71 -45.74 49.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.101 -179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.464 ' O ' ' CD2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -56.54 -61.64 2.28 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.717 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.464 ' HA ' HD21 ' A' ' 16' ' ' LEU . 4.0 tm0? -51.53 -39.3 57.44 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.481 -179.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -75.53 -28.77 59.2 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.509 ' CG2' ' HA ' ' A' ' 85' ' ' ILE . 0.3 OUTLIER -67.69 -27.42 38.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.976 179.031 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.464 ' CD2' ' O ' ' A' ' 12' ' ' LEU . 2.9 mm? -64.8 -29.7 70.68 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.722 178.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.512 ' HA ' ' HD1' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -47.51 -39.95 17.42 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.21 0.529 . . . . 0.0 110.075 179.277 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -73.82 -45.49 51.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.072 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.589 ' HG ' HD12 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -46.9 -42.95 18.39 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.618 -179.836 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.512 ' HD1' ' HA ' ' A' ' 17' ' ' LYS . 40.5 m80 -48.81 -40.82 30.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.869 0.366 . . . . 0.0 111.734 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.485 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 3.9 mmpt? -89.2 5.78 43.17 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.49 ' HB2' ' CG2' ' A' ' 81' ' ' THR . 3.8 m120 -142.03 5.21 1.7 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.468 -0.493 . . . . 0.0 112.274 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.668 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -81.07 -51.91 7.97 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.738 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.5 ' HB3' ' CZ2' ' A' ' 23' ' ' TRP . 8.7 t-160 179.56 58.67 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.939 0.4 . . . . 0.0 110.876 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 116.72 -104.05 1.18 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.061 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -128.81 -146.24 6.14 Favored Glycine 0 N--CA 1.443 -0.9 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.961 179.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.476 ' O ' ' N ' ' A' ' 31' ' ' HIS . 0.1 OUTLIER -94.18 -13.28 26.84 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -49.14 -62.66 1.41 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.8 m-80 -77.32 -27.83 53.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.695 0.283 . . . . 0.0 110.728 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.668 ' HB2' ' CD1' ' A' ' 23' ' ' TRP . 1.3 tm? -68.37 -31.18 70.37 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.476 ' N ' ' O ' ' A' ' 27' ' ' LYS . 3.8 t-80 -45.25 -58.69 3.1 Favored 'General case' 0 CA--C 1.523 -0.091 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.803 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.4 -21.99 52.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.015 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.515 HG13 HD11 ' A' ' 30' ' ' LEU . 1.5 t -87.09 -64.93 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.691 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.492 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 1.1 t70 -59.46 -21.67 60.41 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.234 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.404 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 2.7 m-20 -59.8 -39.84 86.35 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 177.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.44 ' O ' ' CG2' ' A' ' 40' ' ' VAL . 1.3 m-70 -63.51 -52.57 60.64 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 177.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.484 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -54.59 -67.31 0.28 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.684 178.328 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -47.41 -43.49 23.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.182 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -66.86 -25.2 66.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.546 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.564 ' O ' HG13 ' A' ' 44' ' ' ILE . 81.3 t -75.21 -39.86 43.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.418 HG22 ' N ' ' A' ' 42' ' ' GLU . 6.9 tp -43.23 -35.45 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.184 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.418 ' N ' HG22 ' A' ' 41' ' ' ILE . 5.8 pt-20 -75.86 -40.82 53.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.192 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.508 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 4.2 p30 -62.14 -30.79 71.28 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 40' ' ' VAL . 2.3 mt -86.84 -40.55 14.14 Favored 'Isoleucine or valine' 0 C--N 1.337 0.051 0 CA-C-O 121.043 0.449 . . . . 0.0 109.972 178.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.402 ' NE2' HG13 ' A' ' 41' ' ' ILE . 18.6 m170 -59.39 -40.97 88.26 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.423 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -82.59 -10.02 59.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.803 178.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.519 ' HB3' ' HA ' ' A' ' 44' ' ' ILE . 0.0 OUTLIER -87.8 -36.7 17.13 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.161 -179.847 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.471 ' HG3' ' HA2' ' A' ' 3' ' ' GLY . 10.2 ptt? -49.06 -28.8 4.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.296 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -79.07 -21.48 46.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.469 -179.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 117.29 -6.22 17.05 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.558 -0.829 . . . . 0.0 113.04 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.43 -28.62 6.66 Favored Glycine 0 C--N 1.334 0.422 0 C-N-CA 120.571 -0.823 . . . . 0.0 112.078 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -156.09 27.67 0.57 Allowed Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.514 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 25.8 p -74.0 148.37 42.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.025 0.44 . . . . 0.0 111.381 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 74.42 52.96 7.02 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 115.703 -0.681 . . . . 0.0 112.762 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 162.74 -35.03 0.33 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.386 -0.912 . . . . 0.0 113.274 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.455 ' HE2' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -88.35 -38.96 14.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.95 0.375 . . . . 0.0 111.759 -179.478 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.564 ' O ' ' HB3' ' A' ' 61' ' ' MET . 47.1 tp -60.51 -10.91 5.65 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.484 ' O ' ' HG3' ' A' ' 61' ' ' MET . 3.8 pt20 -85.74 -49.33 8.03 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.837 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.41 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 3.7 mt-10 -87.58 -28.94 21.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.95 0.405 . . . . 0.0 110.328 179.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.402 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -77.18 -33.92 56.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.91 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.564 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -53.64 -41.43 66.73 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.106 0.479 . . . . 0.0 110.389 179.748 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 19.1 mmtt -57.75 -24.21 55.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.939 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -42.91 76.88 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.424 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.484 ' CD2' ' O ' ' A' ' 61' ' ' MET . 1.7 p90 -69.92 -29.66 66.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.923 0.392 . . . . 0.0 110.421 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -82.41 -30.58 30.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.41 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.59 -41.25 73.1 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.605 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.487 ' CG1' ' CG1' ' A' ' 33' ' ' VAL . 14.6 t -56.15 -50.09 72.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.027 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.513 ' HG ' HD23 ' A' ' 71' ' ' LEU . 0.4 OUTLIER -63.13 -16.38 59.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.618 179.13 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -65.62 -61.19 2.23 Favored 'General case' 0 C--O 1.231 0.097 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.46 ' CG ' ' CZ3' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -51.06 -36.59 40.74 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.906 0.86 . . . . 0.0 109.401 178.175 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.589 HD12 ' HG ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -70.68 -69.11 0.38 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 113.745 -1.57 . . . . 0.0 112.336 -178.884 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.404 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 2.6 m-20 -50.25 -26.26 4.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.56 -179.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -88.69 9.8 23.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.506 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.625 ' O ' ' N ' ' A' ' 76' ' ' GLN . 79.0 m-70 -153.82 28.72 0.47 Allowed 'General case' 0 CA--C 1.52 -0.18 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.571 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.3 OUTLIER -49.38 85.3 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.016 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.625 ' N ' ' O ' ' A' ' 74' ' ' HIS . 16.9 mm-40 -82.05 -37.74 26.0 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.052 -177.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -83.75 -58.07 2.32 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.223 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 174.53 121.82 0.65 Allowed Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.231 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.571 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 1.3 mtmt -42.75 -30.41 0.38 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -43.18 -35.02 1.25 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.76 0.314 . . . . 0.0 111.417 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.512 ' O ' HG23 ' A' ' 85' ' ' ILE . 1.4 m -69.93 -74.23 0.14 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.554 ' O ' ' N ' ' A' ' 86' ' ' GLU . 27.3 t -48.58 -38.44 9.45 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.403 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.098 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.484 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 1.3 t-80 -50.77 -41.29 56.65 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -76.2 -28.14 57.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.624 178.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.513 HG12 ' HA ' ' A' ' 82' ' ' VAL . 0.2 OUTLIER -85.67 -33.6 7.79 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.14 -179.748 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.554 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -75.3 -45.42 39.9 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.801 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 91' ' ' GLU . 1.5 mp0 -59.62 -29.66 68.15 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 178.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.402 ' O ' ' CD1' ' A' ' 92' ' ' ILE . 1.9 m-80 -82.96 -63.58 1.34 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.438 179.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.484 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -55.03 -43.77 71.12 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.22 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.468 -179.73 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -63.37 -29.32 70.65 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.133 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 87' ' ' GLN . 0.4 OUTLIER -90.39 -6.81 54.53 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.102 178.522 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.529 ' O ' ' HG ' ' A' ' 96' ' ' LEU . 1.1 mp -72.9 -42.25 60.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.638 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -58.47 -27.65 64.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.365 178.763 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.638 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.0 OUTLIER -62.47 -63.88 1.09 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.169 -179.222 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 11.8 m80 -64.21 -10.5 23.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.144 178.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 31.3 mt -88.52 -55.57 3.67 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.086 0.47 . . . . 0.0 110.061 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.428 ' N ' HD21 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -72.9 -7.88 53.0 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.932 178.7 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -90.96 -25.26 19.84 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.758 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.439 HD11 ' CD2' ' A' ' 5' ' ' LEU . 15.9 tp -70.17 -52.77 20.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.157 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 33.4 t -69.64 -27.99 35.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.423 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -77.51 -38.58 48.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.761 0.315 . . . . 0.0 110.975 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.953 -179.897 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.181 -0.368 . . . . 0.0 112.181 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.77 -16.67 61.77 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 120.567 0.222 . . . . 0.0 110.589 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.39 -23.92 4.31 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 177.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.481 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 23.4 t-20 -63.64 -46.51 85.36 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.612 178.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -48.62 -35.12 12.96 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -88.07 -29.13 20.87 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.144 178.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 0.4 OUTLIER -70.06 -33.03 71.42 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.056 0.455 . . . . 0.0 110.292 179.829 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -54.54 -40.68 68.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.235 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.443 ' HA ' ' HG2' ' A' ' 14' ' ' GLU . 0.4 OUTLIER -48.32 -43.77 33.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.931 0.396 . . . . 0.0 110.848 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.493 ' O ' HG13 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -57.79 -60.53 3.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.768 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.429 ' HA ' HD23 ' A' ' 16' ' ' LEU . 4.8 tp60 -51.47 -41.36 60.84 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.555 -179.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.443 ' HG2' ' HA ' ' A' ' 11' ' ' ASP . 10.8 pt-20 -74.21 -22.02 59.55 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.846 0.355 . . . . 0.0 110.203 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.493 HG13 ' O ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -74.21 -27.14 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.254 179.249 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.471 ' HA ' ' HB3' ' A' ' 19' ' ' LEU . 3.1 mm? -65.54 -34.62 78.68 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.356 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.82 -42.99 8.35 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 121.104 0.478 . . . . 0.0 110.247 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -68.35 -42.86 78.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.477 0.656 . . . . 0.0 109.263 178.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.603 ' HG ' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -53.66 -37.05 62.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.814 179.683 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.548 ' HA ' ' HG ' ' A' ' 30' ' ' LEU . 49.3 m-70 -54.04 -34.48 60.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.386 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.519 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.4 mmpt? -94.29 3.39 55.28 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -138.91 -1.43 1.79 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.562 ' CB ' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -72.88 -56.02 5.79 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.21 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.561 ' HB3' ' CH2' ' A' ' 23' ' ' TRP . 8.2 t-160 179.04 47.18 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.843 178.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 51.26 172.57 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.106 -0.569 . . . . 0.0 113.205 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.6 78.92 0.13 Allowed Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 121.012 -0.614 . . . . 0.0 112.283 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -27.05 5.52 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.95 -30.65 66.14 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.85 178.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -78.81 -40.51 32.77 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.548 ' HG ' ' HA ' ' A' ' 20' ' ' HIS . 1.1 tm? -65.97 -36.38 83.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.383 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.422 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 0.3 OUTLIER -46.48 -43.43 16.71 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.239 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.5 -21.3 55.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.467 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.524 HG13 ' O ' ' A' ' 30' ' ' LEU . 0.6 OUTLIER -88.3 -46.36 15.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.11 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.458 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 2.6 t0 -74.58 -34.33 62.86 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 179.374 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.422 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 2.3 t30 -53.28 -29.17 31.81 Favored 'General case' 0 C--N 1.334 -0.077 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -57.05 -52.95 63.22 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.806 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.47 HD23 ' HG ' ' A' ' 16' ' ' LEU . 0.2 OUTLIER -77.1 -32.71 56.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.826 178.825 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.413 ' N ' ' HG ' ' A' ' 37' ' ' LEU . 2.2 tm0? -54.96 -37.47 66.53 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -83.42 -18.3 39.18 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.952 178.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.578 ' O ' HG13 ' A' ' 44' ' ' ILE . 55.3 t -75.97 -40.81 38.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.125 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 2.3 tp -45.53 -35.9 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.278 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.56 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 0.4 OUTLIER -75.56 -28.03 58.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.561 179.546 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.574 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 1.3 m-20 -79.38 -26.32 42.01 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.737 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.578 HG13 ' O ' ' A' ' 40' ' ' VAL . 2.8 mt -86.17 -57.69 4.08 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.856 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.56 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -58.76 -27.31 64.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.04 -179.948 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.503 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 27.6 t0 -86.67 -26.36 24.35 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.574 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.9 m-85 -83.74 -52.49 6.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.273 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.433 ' CE ' ' N ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -51.97 -21.64 3.23 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.399 -179.411 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.08 16.09 10.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.348 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 102.41 31.99 5.04 Favored Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.89 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -111.22 24.98 14.71 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.614 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.72 25.74 9.63 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.643 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -20.02 55.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.636 0.255 . . . . 0.0 111.235 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -77.02 70.86 2.28 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.982 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.448 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . 133.64 -7.33 4.91 Favored Glycine 0 CA--C 1.518 0.223 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.953 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.46 ' HE3' ' CD2' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -88.73 -37.48 15.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.669 0.271 . . . . 0.0 111.213 -179.89 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.482 ' O ' ' CB ' ' A' ' 61' ' ' MET . 0.0 OUTLIER -63.59 -11.98 29.29 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.248 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 1.7 pp0? -86.03 -49.92 7.44 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.551 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -86.92 -30.46 21.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.753 0.311 . . . . 0.0 110.576 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.41 ' CG ' ' HD3' ' A' ' 56' ' ' LYS . 0.6 OUTLIER -77.88 -31.06 51.13 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.753 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.482 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -55.17 -33.82 63.3 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.896 0.379 . . . . 0.0 110.489 179.771 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.3 tttt -67.39 -26.15 66.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.092 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -70.51 -37.25 74.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.692 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.466 ' CZ ' HG22 ' A' ' 92' ' ' ILE . 0.3 OUTLIER -85.09 -27.8 26.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.939 0.4 . . . . 0.0 110.438 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -82.45 -29.9 30.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.231 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 69' ' ' ASP . 1.1 tm0? -62.7 -36.09 81.83 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.597 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.51 HG12 HG12 ' A' ' 33' ' ' VAL . 72.1 t -52.18 -39.97 28.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.7 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.544 ' CD2' HG13 ' A' ' 85' ' ' ILE . 1.0 OUTLIER -73.67 -5.3 39.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.004 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 66' ' ' GLN . 2.2 m-20 -78.08 -56.38 4.52 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.445 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 4.8 tp10 -52.43 -32.5 39.66 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 122.029 0.919 . . . . 0.0 108.788 177.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.603 HD11 ' HG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -79.13 -64.98 1.06 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.883 -179.106 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.409 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 65.2 t30 -50.46 -24.73 3.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.748 -179.277 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -88.74 3.89 49.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.817 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.497 ' O ' ' N ' ' A' ' 76' ' ' GLN . 91.3 m-70 -147.19 26.97 1.06 Allowed 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.523 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -49.5 91.95 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.027 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 74' ' ' HIS . 13.2 tt0 -64.54 68.23 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.594 -178.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 56.33 29.08 56.19 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.666 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -138.96 48.92 0.84 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.385 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.523 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -55.42 -36.09 66.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.541 0.21 . . . . 0.0 111.496 -179.764 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -45.26 -32.87 2.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.636 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.533 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.2 m -69.69 -74.64 0.13 Allowed 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.524 ' HA ' HG12 ' A' ' 85' ' ' ILE . 38.3 t -48.83 -38.81 10.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.98 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.482 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -50.26 -41.57 50.63 Favored 'General case' 0 CA--C 1.522 -0.12 0 CA-C-O 121.145 0.498 . . . . 0.0 109.713 179.405 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -76.16 -27.21 56.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.564 178.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.544 HG13 ' CD2' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.52 -35.76 10.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.074 -179.846 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.482 ' CG ' ' HA ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -71.24 -44.69 64.83 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.477 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -61.53 -29.05 69.75 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.417 ' O ' ' CD1' ' A' ' 92' ' ' ILE . 2.1 m-80 -83.01 -64.75 1.11 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.222 178.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.472 ' HA ' ' HB ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -54.12 -50.85 52.01 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.41 -179.745 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.407 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 7.2 mmmt -59.78 -29.5 68.24 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.007 -0.677 . . . . 0.0 109.725 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -90.83 -3.23 57.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.361 178.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.472 ' HB ' ' HA ' ' A' ' 89' ' ' ILE . 1.1 mp -78.69 -40.09 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.633 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -60.01 -26.41 66.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.298 178.886 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.633 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 4.0 t60 -62.35 -65.44 0.69 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.157 -179.25 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -61.7 -10.71 9.24 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.207 178.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.466 ' HB3' HD13 ' A' ' 57' ' ' LEU . 44.2 mt -89.34 -63.5 1.28 Allowed 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.943 0.401 . . . . 0.0 110.566 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -67.87 -11.77 59.32 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.324 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.421 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 0.9 OUTLIER -89.7 -13.12 37.58 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.879 179.565 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 10.0 tp -82.01 -56.45 3.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.016 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.9 t -66.67 -43.77 90.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.499 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -59.86 -28.33 67.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.015 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 32.7 ttt-85 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.859 179.938 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 CA-C-O 120.442 -0.088 . . . . 0.0 112.9 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -87.96 -19.41 27.28 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.744 0.272 . . . . 0.0 110.74 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.456 ' N ' ' HE2' ' A' ' 48' ' ' MET . 0.1 OUTLIER -54.62 -19.3 5.76 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.728 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -61.15 -44.9 96.59 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.961 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -49.75 -28.08 5.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.045 0.45 . . . . 0.0 110.139 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -87.64 -28.24 21.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.409 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.472 ' O ' HD12 ' A' ' 12' ' ' LEU . 8.7 mt -73.18 -38.6 66.1 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.858 0.361 . . . . 0.0 110.774 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -42.83 -32.85 0.67 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.446 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.0 -52.2 13.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.519 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.547 ' CB ' HG12 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -50.98 -43.2 60.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.301 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.447 ' HA ' HD23 ' A' ' 16' ' ' LEU . 2.0 tt0 -73.51 -38.08 65.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.626 0.251 . . . . 0.0 111.5 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -73.89 -27.58 61.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.08 0.467 . . . . 0.0 110.132 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.577 HG12 ' HB ' ' A' ' 85' ' ' ILE . 0.9 OUTLIER -64.83 -24.34 35.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.333 179.163 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.523 ' CD2' ' O ' ' A' ' 12' ' ' LEU . 1.1 mm? -66.49 -37.94 86.17 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.237 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.48 -33.17 1.62 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 121.172 0.511 . . . . 0.0 110.288 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -76.79 -45.84 27.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.903 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.595 ' HG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -47.85 -42.61 26.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.267 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.515 ' CE1' ' CD1' ' A' ' 30' ' ' LEU . 56.3 m-70 -48.43 -42.46 32.32 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.266 -0.424 . . . . 0.0 112.035 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.434 ' HE3' ' C ' ' A' ' 20' ' ' HIS . 0.0 OUTLIER -86.24 5.01 36.33 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -177.248 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.484 ' HB2' ' CG2' ' A' ' 81' ' ' THR . 9.0 m-80 -146.01 12.63 1.26 Allowed 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.383 -0.527 . . . . 0.0 112.135 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.692 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -84.78 -33.59 22.97 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.893 179.87 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.477 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 3.1 t-160 -178.32 -51.18 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.646 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.81 138.73 2.96 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.755 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.44 104.37 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.394 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.4 tttt -53.01 -23.79 8.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.697 0.284 . . . . 0.0 110.775 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -50.91 -31.94 19.15 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.804 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -85.99 -46.91 10.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.496 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.692 ' HB2' ' CD1' ' A' ' 23' ' ' TRP . 2.0 tm? -60.31 -29.96 69.19 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.404 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 17.0 t-160 -45.69 -56.44 5.25 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.694 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.12 -24.1 62.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.967 0.413 . . . . 0.0 110.779 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.503 ' CG1' HD22 ' A' ' 30' ' ' LEU . 1.3 t -84.66 -66.1 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.522 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.459 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -57.87 -23.25 52.2 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.298 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.404 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 16.3 m-20 -56.97 -39.44 74.61 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 177.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.54 -45.63 78.79 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.72 -1.127 . . . . 0.0 108.028 177.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.488 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -56.7 -67.13 0.34 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.794 178.612 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -44.58 -41.79 6.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.056 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -62.21 -29.8 70.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.299 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.567 ' O ' HG12 ' A' ' 44' ' ' ILE . 97.6 t -62.54 -54.82 28.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.27 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.472 ' CG2' ' CE1' ' A' ' 45' ' ' HIS . 17.3 mm -42.5 -46.13 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.938 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.429 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 1.1 pt-20 -68.02 -29.86 68.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.884 0.373 . . . . 0.0 110.405 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.557 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.9 OUTLIER -81.39 -25.2 36.45 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.921 -0.582 . . . . 0.0 109.96 178.848 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.567 HG12 ' O ' ' A' ' 40' ' ' VAL . 9.1 mm -87.17 -38.19 11.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.67 179.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.472 ' CE1' ' CG2' ' A' ' 41' ' ' ILE . 11.6 m170 -78.03 -42.3 32.93 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.633 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -72.04 -27.6 62.81 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.82 0.343 . . . . 0.0 110.47 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.557 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.8 m-85 -88.48 -45.61 9.8 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.456 ' HE2' ' N ' ' A' ' 5' ' ' LEU . 8.1 ptm -46.7 -38.16 9.45 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 120.813 0.34 . . . . 0.0 111.443 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.47 -21.33 66.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.299 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 133.05 24.93 0.69 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.945 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -102.29 35.25 5.09 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.137 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.11 32.57 4.29 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.221 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 88.8 p -59.61 -22.48 61.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.687 0.28 . . . . 0.0 111.107 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -91.91 75.1 1.44 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.52 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 145.26 -17.14 1.9 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.619 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.46 ' O ' ' CB ' ' A' ' 60' ' ' MET . 2.9 pptp? -88.21 -39.97 14.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.783 0.325 . . . . 0.0 110.915 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.528 ' O ' ' CB ' ' A' ' 61' ' ' MET . 7.0 tp -65.85 -9.38 28.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.943 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -86.15 -50.08 7.27 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.311 -0.556 . . . . 0.0 110.696 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -87.39 -30.68 20.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.474 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.46 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 17.5 tpp -78.14 -33.11 50.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.163 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.528 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 2.4 tmm? -56.12 -41.97 76.12 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 120.189 -0.604 . . . . 0.0 109.843 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.04 -26.69 65.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.918 178.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.27 -34.4 78.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.049 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.507 ' CZ ' HG23 ' A' ' 92' ' ' ILE . 0.9 OUTLIER -87.38 -26.46 23.31 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.851 0.358 . . . . 0.0 110.606 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -82.64 -32.41 28.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.826 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -57.41 -39.3 75.87 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.202 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.495 ' CG1' ' CG1' ' A' ' 33' ' ' VAL . 13.0 t -50.19 -44.67 23.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.005 0.431 . . . . 0.0 110.584 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.503 ' CD2' HG13 ' A' ' 85' ' ' ILE . 0.7 OUTLIER -66.25 -13.81 60.96 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.059 179.534 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -67.84 -58.61 4.3 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.474 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 1.9 tp10 -52.81 -37.51 60.04 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 122.0 0.905 . . . . 0.0 109.486 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.595 HD13 ' HG ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -72.11 -69.4 0.4 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.652 -1.613 . . . . 0.0 112.565 -178.76 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.12 -26.69 4.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.687 -179.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -90.97 12.4 19.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.244 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.6 ' O ' ' N ' ' A' ' 76' ' ' GLN . 79.4 m-70 -156.33 30.08 0.34 Allowed 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.512 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -50.7 85.25 0.0 OUTLIER 'General case' 0 C--O 1.232 0.157 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.6 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -81.49 -37.54 27.76 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.837 -177.637 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -82.21 -65.85 1.61 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.783 -0.722 . . . . 0.0 113.183 -179.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -179.12 120.12 0.68 Allowed Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.171 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.512 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -40.08 -30.71 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.672 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -44.75 -34.46 2.28 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.848 0.356 . . . . 0.0 111.263 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.484 ' CG2' ' HB2' ' A' ' 22' ' ' ASN . 1.8 m -68.67 -73.26 0.15 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.543 ' HA ' HG12 ' A' ' 85' ' ' ILE . 24.3 t -50.24 -38.8 15.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.169 179.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.456 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -48.83 -40.83 30.84 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.401 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -76.2 -29.46 57.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.62 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.577 ' HB ' HG12 ' A' ' 15' ' ' VAL . 0.2 OUTLIER -85.54 -35.4 9.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.36 -179.529 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.525 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -73.79 -39.62 64.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.697 0.284 . . . . 0.0 110.248 179.316 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.418 ' O ' ' CB ' ' A' ' 91' ' ' GLU . 2.3 mp0 -67.07 -31.05 71.28 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -83.02 -44.24 15.44 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.594 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.569 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.1 OUTLIER -74.1 -54.87 13.88 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.564 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.275 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.569 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 5.9 mmmt -58.56 -28.98 66.02 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.224 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.418 ' CB ' ' O ' ' A' ' 87' ' ' GLN . 2.1 tt0 -90.92 -2.62 57.71 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.547 HG12 ' CB ' ' A' ' 12' ' ' LEU . 1.2 tp -78.82 -49.06 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.321 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.649 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.2 OUTLIER -48.29 -26.34 1.96 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.49 179.284 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.649 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 20.6 t-80 -65.1 -66.74 0.5 Allowed 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.816 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -60.79 -12.79 11.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.982 -0.553 . . . . 0.0 109.894 178.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.49 ' CD1' HG22 ' A' ' 92' ' ' ILE . 22.1 mt -86.04 -64.96 1.07 Allowed 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 120.952 0.406 . . . . 0.0 110.133 179.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.31 -16.7 55.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.789 178.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -86.96 2.67 48.66 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.668 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.412 HD11 ' CD2' ' A' ' 5' ' ' LEU . 16.5 tp -100.81 -63.02 1.17 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.969 0.414 . . . . 0.0 110.796 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 39.8 t -61.86 -28.73 44.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.391 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 38.2 m170 -96.59 33.63 1.8 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.021 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.874 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 N-CA-C 112.777 -0.129 . . . . 0.0 112.777 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 26.6 tptp -95.57 -21.17 18.43 Favored 'General case' 0 CA--C 1.507 -0.674 0 CA-C-O 120.599 0.237 . . . . 0.0 110.637 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.418 ' CD2' HD13 ' A' ' 99' ' ' LEU . 0.2 OUTLIER -52.04 -23.12 4.77 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.261 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.469 ' HB3' ' CE ' ' A' ' 48' ' ' MET . 26.4 p-10 -60.02 -40.18 88.42 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.569 178.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -49.84 -29.83 8.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.123 0.487 . . . . 0.0 110.027 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.419 ' HG ' ' CD2' ' A' ' 95' ' ' HIS . 2.4 tm? -85.06 -31.25 23.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.247 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.419 ' HG ' HD22 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -68.3 -33.72 74.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.459 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -48.58 -45.51 38.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.324 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -40.67 78.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.776 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.53 ' HG ' ' N ' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -59.51 -63.4 1.32 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.747 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.53 ' N ' ' HG ' ' A' ' 12' ' ' LEU . 13.0 tt0 -48.61 -41.17 30.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.617 -179.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -71.38 -30.12 65.76 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.101 0.477 . . . . 0.0 109.867 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.637 ' CG2' ' HA ' ' A' ' 85' ' ' ILE . 0.4 OUTLIER -66.11 -23.77 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.225 178.9 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.507 ' HA ' HD13 ' A' ' 85' ' ' ILE . 3.8 mm? -67.7 -33.92 75.86 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 177.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.403 ' HA ' ' CE ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -42.05 -42.16 2.8 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 121.189 0.518 . . . . 0.0 109.971 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.511 ' C ' HG22 ' A' ' 81' ' ' THR . 6.4 m-20 -64.37 -49.11 72.94 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.258 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.574 ' HB2' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -48.15 -57.16 6.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.719 -179.999 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.509 ' HA ' ' HG ' ' A' ' 30' ' ' LEU . 40.8 m-70 -45.25 -27.62 0.67 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.507 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.4 mmpt? -94.29 -20.09 20.1 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -177.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.415 ' O ' HD12 ' A' ' 75' ' ' LEU . 25.3 m120 -122.99 -6.25 8.43 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.59 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -59.66 -33.28 71.34 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.894 -179.793 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.503 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 78.7 t60 -175.97 -52.65 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.566 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.5 129.35 1.73 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.844 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 71.55 115.09 0.05 OUTLIER Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.354 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -58.66 -18.61 32.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.569 0.224 . . . . 0.0 110.862 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -51.64 -38.1 53.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.627 0.251 . . . . 0.0 110.927 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -83.79 -44.63 14.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.466 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.59 ' HB2' ' CD1' ' A' ' 23' ' ' TRP . 1.4 tm? -62.1 -27.3 68.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.137 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.404 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.2 OUTLIER -48.62 -36.09 15.05 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.627 179.876 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.11 -25.07 55.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.975 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.494 ' CG1' HD23 ' A' ' 30' ' ' LEU . 1.9 t -87.45 -56.67 5.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.758 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.453 ' CB ' ' CE1' ' A' ' 20' ' ' HIS . 0.5 OUTLIER -59.02 -25.39 63.63 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.475 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.404 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 1.0 OUTLIER -58.73 -40.41 83.69 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 178.145 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.4 ' CD2' ' OE1' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.48 -49.78 72.27 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 177.777 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.488 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -55.47 -67.92 0.24 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.55 178.379 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.3 tm0? -45.68 -42.8 12.03 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.016 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -61.89 -30.69 71.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.326 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.538 ' O ' HG12 ' A' ' 44' ' ' ILE . 61.8 t -64.39 -52.69 52.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.357 179.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.439 HG22 ' CE1' ' A' ' 45' ' ' HIS . 1.5 mp -42.77 -41.15 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.722 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.425 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 0.1 OUTLIER -72.77 -28.3 62.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.925 0.393 . . . . 0.0 110.429 179.775 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.524 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 1.1 m-20 -84.03 -28.87 27.35 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.899 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.538 HG12 ' O ' ' A' ' 40' ' ' VAL . 18.2 mm -86.67 -39.01 12.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.972 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.439 ' CE1' HG22 ' A' ' 41' ' ' ILE . 11.6 m170 -77.94 -36.55 49.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.643 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.409 ' CB ' ' O ' ' A' ' 42' ' ' GLU . 9.8 t70 -76.62 -27.67 55.81 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.67 0.271 . . . . 0.0 110.533 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.524 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 4.1 m-85 -88.35 -43.4 11.54 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.908 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.469 ' CE ' ' HB3' ' A' ' 6' ' ' ASN . 25.5 ptt? -46.6 -29.57 1.88 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.807 0.337 . . . . 0.0 111.457 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -68.61 -28.11 66.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.105 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 141.21 -12.5 2.8 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.875 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -55.13 -22.63 29.61 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.716 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 155.21 55.0 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.281 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.2 t -76.17 -20.16 57.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.601 0.239 . . . . 0.0 111.39 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.8 74.03 2.11 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.542 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 145.6 -17.52 1.84 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.637 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.452 ' O ' ' CB ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.18 -43.08 11.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.673 0.273 . . . . 0.0 111.086 179.893 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.51 ' O ' ' CB ' ' A' ' 61' ' ' MET . 44.9 tp -64.34 -10.29 23.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.739 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -85.97 -49.75 7.6 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.853 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -87.14 -30.13 21.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.343 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.452 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 3.7 tpt -78.11 -31.39 49.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.861 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.51 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -56.16 -39.01 71.65 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.315 179.714 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.69 -11.57 60.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.144 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.4 ' OE1' ' CD2' ' A' ' 36' ' ' HIS . 3.3 tp10 -84.82 -26.25 27.57 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.46 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.461 ' CD1' ' C ' ' A' ' 64' ' ' PHE . 1.4 p90 -87.19 -28.81 22.19 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.749 0.309 . . . . 0.0 110.92 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.38 -30.28 30.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.701 179.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -30.7 67.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.825 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.488 ' CG2' ' HB2' ' A' ' 37' ' ' LEU . 24.3 t -57.43 -59.87 2.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.566 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.464 HD13 HD11 ' A' ' 85' ' ' ILE . 1.7 mp -61.04 -13.7 18.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.369 178.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -66.82 -52.28 45.63 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.47 ' CG ' ' CZ3' ' A' ' 23' ' ' TRP . 0.2 OUTLIER -58.62 -33.63 70.25 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.76 0.79 . . . . 0.0 108.941 177.69 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.574 HD11 ' HB2' ' A' ' 19' ' ' LEU . 0.8 OUTLIER -63.76 -65.91 0.62 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.265 -1.334 . . . . 0.0 111.851 -179.516 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 15.1 t30 -49.77 -23.91 2.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.708 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -85.24 -3.51 58.84 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 33.4 m-70 -150.92 36.49 0.62 Allowed 'General case' 0 CA--C 1.52 -0.188 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.5 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 0.5 OUTLIER -67.46 85.35 0.17 Allowed 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.343 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -68.03 65.75 0.1 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.97 -178.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.94 54.41 21.73 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.463 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -154.15 28.67 0.72 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.577 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.1 mmpt? -43.11 -27.35 0.21 Allowed 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 22.8 p80 -57.5 -41.22 80.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.162 0.506 . . . . 0.0 110.514 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.511 HG22 ' C ' ' A' ' 18' ' ' ASN . 1.4 m -58.65 -52.35 66.06 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.156 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.725 ' HA ' ' CG2' ' A' ' 85' ' ' ILE . 0.2 OUTLIER -57.95 -60.05 2.67 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.529 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.55 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 60.8 t-80 -42.88 -40.02 2.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.877 0.37 . . . . 0.0 110.485 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -76.28 -49.05 18.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.177 179.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.725 ' CG2' ' HA ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -75.34 -16.74 15.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.723 -179.231 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.618 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -93.08 -44.1 8.55 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 179.196 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.469 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 1.1 mp0 -62.69 -23.94 67.39 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 177.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.454 ' CB ' HG22 ' A' ' 15' ' ' VAL . 1.3 m-80 -82.73 -59.49 2.49 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 114.491 -1.231 . . . . 0.0 110.07 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.595 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -65.07 -49.68 78.24 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.35 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.453 -179.743 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.421 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 1.3 tptp -58.47 -27.33 64.3 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.494 -0.482 . . . . 0.0 109.941 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -90.7 -4.69 56.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.25 178.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.503 ' O ' ' HG ' ' A' ' 96' ' ' LEU . 1.0 OUTLIER -78.65 -48.02 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 179.525 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.627 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.2 OUTLIER -48.06 -28.21 2.72 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.456 179.16 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.627 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 34.0 t-80 -62.6 -63.51 1.2 Allowed 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.986 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.419 ' CD2' ' HG ' ' A' ' 8' ' ' LEU . 22.8 m-70 -65.8 -9.17 26.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.182 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 19.3 mt -89.19 -59.87 2.1 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 120.982 0.42 . . . . 0.0 110.149 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.433 ' N ' HD21 ' A' ' 57' ' ' LEU . 87.2 mt-10 -69.0 -12.47 61.71 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.851 178.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -85.97 -22.51 27.32 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.625 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.418 HD13 ' CD2' ' A' ' 5' ' ' LEU . 27.8 tp -75.29 -60.47 2.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.896 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.6 t -59.88 -41.09 84.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.389 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.4 -30.56 70.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.919 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.824 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 CA-C-O 120.435 -0.092 . . . . 0.0 113.024 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.82 -19.78 61.26 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 116.758 0.279 . . . . 0.0 111.193 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.93 -23.34 4.85 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.453 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 16.5 t-20 -65.53 -36.26 83.29 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.766 179.001 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -48.5 -35.79 13.85 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -88.25 -29.0 20.75 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.093 178.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.463 ' O ' HD21 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -71.83 -27.01 62.62 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 120.825 0.345 . . . . 0.0 110.619 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -58.55 -46.23 87.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.269 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -46.59 -39.03 10.42 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.985 0.422 . . . . 0.0 111.201 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.51 ' O ' HG11 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -58.53 -61.47 2.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.663 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.454 ' HA ' HD22 ' A' ' 16' ' ' LEU . 1.8 tt0 -52.19 -34.9 47.45 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.791 -179.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.33 -29.7 53.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.889 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.51 HG11 ' O ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -65.05 -34.52 71.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.834 179.104 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.507 ' N ' HG13 ' A' ' 15' ' ' VAL . 3.8 mm? -57.13 -36.59 70.88 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.072 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.76 -45.08 4.66 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.127 0.489 . . . . 0.0 110.329 179.075 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 59.3 m-80 -67.32 -44.42 79.19 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.324 178.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.613 ' HG ' HD12 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -52.82 -35.6 57.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.065 179.791 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.506 ' HA ' ' HG ' ' A' ' 30' ' ' LEU . 26.7 m-70 -55.18 -31.66 61.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.641 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.475 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 6.4 mmpt? -94.38 -4.59 48.18 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -178.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 75' ' ' LEU . 3.5 m-80 -128.06 -13.82 5.04 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.567 ' CB ' HD12 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -60.65 -38.47 84.96 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.573 -179.916 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.467 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 33.3 t60 -175.2 -48.66 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.861 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 143.28 126.6 2.04 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.409 -0.9 . . . . 0.0 112.819 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 88.02 100.13 0.92 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.316 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.38 -26.03 4.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.717 0.294 . . . . 0.0 110.566 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -55.63 -30.02 60.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.507 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -86.97 -35.19 19.0 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.436 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.561 ' CD2' ' CD1' ' A' ' 23' ' ' TRP . 1.2 tm? -71.86 -32.87 67.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.874 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.412 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.1 OUTLIER -50.38 -36.24 31.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.846 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.72 -25.96 54.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.551 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 30' ' ' LEU . 2.8 p -89.8 -48.84 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.26 -179.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.492 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 2.3 t70 -69.08 -23.75 64.06 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 1.3 m120 -54.05 -36.14 62.76 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.186 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -33.52 75.43 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.309 178.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.41 ' O ' ' N ' ' A' ' 40' ' ' VAL . 0.1 OUTLIER -74.51 -64.25 1.07 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.24 179.184 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -46.23 -31.54 2.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.39 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.43 -28.51 59.38 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.919 0.39 . . . . 0.0 110.376 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.509 ' O ' HG12 ' A' ' 44' ' ' ILE . 53.3 t -73.4 -46.42 49.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.659 179.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 2.7 tp -45.47 -34.72 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.386 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.607 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 1.4 mt-10 -75.65 -30.95 59.62 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.646 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.532 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -82.8 -25.69 32.48 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.875 178.754 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 40' ' ' VAL . 31.0 mm -87.29 -47.53 15.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.678 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.607 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -70.97 -26.9 63.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.865 -178.957 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.504 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 69.3 m-20 -86.65 -40.72 14.84 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.07 0.462 . . . . 0.0 110.302 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.532 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 4.3 m-85 -72.3 -40.94 67.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.216 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 16.7 ptp -53.29 -26.9 20.23 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.817 0.341 . . . . 0.0 111.072 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -79.71 -1.4 38.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.436 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 120.04 18.38 4.27 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.863 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.403 ' O ' ' CD2' ' A' ' 47' ' ' PHE . . . -95.97 28.1 13.99 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.453 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.27 38.98 3.86 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.448 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.1 p -62.45 -25.68 68.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.773 0.321 . . . . 0.0 111.182 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.42 70.92 3.01 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.531 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.405 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . 150.19 -20.86 1.09 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.798 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.478 ' O ' ' CB ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.44 -46.0 9.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.618 0.246 . . . . 0.0 111.473 -179.814 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.559 ' O ' ' HB3' ' A' ' 61' ' ' MET . 13.7 tp -62.6 -9.28 8.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.301 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.487 ' O ' ' HG2' ' A' ' 61' ' ' MET . 16.9 pt20 -86.2 -50.83 6.69 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.815 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 17.4 mm-40 -87.66 -28.31 21.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.951 0.405 . . . . 0.0 110.302 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.478 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 9.3 tpp -78.23 -33.15 50.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.042 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.559 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 3.8 ptt? -55.44 -38.99 69.73 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.547 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.62 -15.57 62.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.898 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.403 ' HB3' HG23 ' A' ' 40' ' ' VAL . 75.0 tt0 -79.32 -25.4 42.35 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.732 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.503 ' CD2' ' O ' ' A' ' 61' ' ' MET . 2.0 p90 -86.95 -35.39 18.91 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.903 0.382 . . . . 0.0 110.467 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.478 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 0.0 OUTLIER -74.47 -31.2 62.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.545 179.294 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -57.91 -33.99 69.35 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.505 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.439 HG11 HG12 ' A' ' 33' ' ' VAL . 72.0 t -58.09 -47.09 87.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.079 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.506 ' HG ' HD23 ' A' ' 71' ' ' LEU . 1.3 mp -65.31 -14.68 61.33 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.269 178.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -66.37 -62.02 1.69 Allowed 'General case' 0 C--O 1.231 0.094 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.458 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 14.4 tp10 -50.82 -32.1 19.1 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.787 0.804 . . . . 0.0 109.314 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.613 HD12 ' HG ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -74.52 -69.41 0.46 Allowed 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 113.979 -1.464 . . . . 0.0 112.232 -178.939 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -49.49 -26.3 3.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.702 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.64 6.26 28.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.557 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.593 ' O ' ' N ' ' A' ' 76' ' ' GLN . 66.6 m-70 -152.15 32.71 0.53 Allowed 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.565 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -54.65 83.28 0.0 OUTLIER 'General case' 0 CA--C 1.521 -0.135 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.789 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.593 ' N ' ' O ' ' A' ' 74' ' ' HIS . 1.0 OUTLIER -83.9 -34.07 24.62 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.947 -177.425 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -83.85 -66.45 1.49 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.615 -0.802 . . . . 0.0 113.062 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -174.35 116.88 0.6 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.115 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.565 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -44.28 -29.78 0.71 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.634 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -45.58 -30.81 1.6 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.838 0.352 . . . . 0.0 111.032 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.529 ' O ' HG21 ' A' ' 85' ' ' ILE . 1.2 m -69.93 -74.4 0.14 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.534 ' HA ' HG12 ' A' ' 85' ' ' ILE . 22.2 t -48.92 -40.88 12.8 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.384 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.034 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.481 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -48.97 -41.31 33.78 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.089 0.471 . . . . 0.0 109.737 179.541 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.413 ' O ' ' HB3' ' A' ' 88' ' ' ASN . 0.6 OUTLIER -76.25 -27.58 56.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.696 178.865 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.534 HG12 ' HA ' ' A' ' 82' ' ' VAL . 0.2 OUTLIER -85.61 -36.16 10.48 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.165 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.151 -179.611 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.481 ' CG ' ' HA ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -71.93 -43.68 64.88 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.213 -0.292 . . . . 0.0 110.213 179.433 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -62.41 -29.46 70.51 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.451 ' ND2' ' N ' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -82.92 -57.3 3.35 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.305 179.122 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.486 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -61.56 -48.23 89.73 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.374 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.97 -179.616 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.434 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 20.6 tptp -61.46 -28.57 69.38 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 120.291 -0.564 . . . . 0.0 109.494 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -90.73 -2.24 57.82 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.094 178.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.454 ' HB ' ' HA ' ' A' ' 89' ' ' ILE . 1.0 OUTLIER -78.62 -43.27 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.355 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.637 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -54.97 -26.64 37.98 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.149 178.692 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.637 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.1 OUTLIER -62.87 -65.73 0.64 Allowed 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.84 -179.523 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.15 -12.1 7.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.108 178.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 55.5 mt -89.29 -65.7 0.99 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.529 179.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.432 ' N ' HD21 ' A' ' 57' ' ' LEU . 4.2 mm-40 -63.09 -16.36 59.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.17 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 94' ' ' HIS . 56.6 tt0 -87.83 -10.73 49.95 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.745 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 30.0 tp -81.4 -57.18 3.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.644 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 41.1 t -62.35 -31.13 50.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.276 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -69.4 -40.61 77.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.919 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.293 -0.861 . . . . 0.0 110.921 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 N-CA-C 112.488 -0.245 . . . . 0.0 112.488 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 tptm -59.96 -17.44 38.09 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 116.611 0.205 . . . . 0.0 110.928 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.429 ' HB2' HD12 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -49.27 -25.56 2.43 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.111 -0.699 . . . . 0.0 109.111 178.041 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -59.29 -41.2 88.39 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.832 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -50.42 -31.45 15.04 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.204 0.526 . . . . 0.0 110.001 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -83.49 -30.61 27.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.024 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.451 ' O ' HD23 ' A' ' 12' ' ' LEU . 8.8 mt -60.79 -42.78 98.25 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.555 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -45.5 -40.05 8.05 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.487 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -54.65 -43.02 72.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.987 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.455 HD12 HG13 ' A' ' 89' ' ' ILE . 0.0 OUTLIER -56.57 -63.36 1.22 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.534 179.805 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.456 ' HA ' HD23 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -52.41 -37.77 57.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.314 -179.14 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -75.18 -26.73 59.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.941 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.484 HG13 ' HB ' ' A' ' 85' ' ' ILE . 0.5 OUTLIER -68.89 -28.52 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.09 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.598 ' O ' HD21 ' A' ' 19' ' ' LEU . 1.6 mm? -67.48 -34.63 77.55 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.312 179.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 ttpp -40.45 -33.94 0.3 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.151 0.501 . . . . 0.0 110.515 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.404 ' HB3' ' CG2' ' A' ' 81' ' ' THR . 2.2 m-20 -81.18 -41.53 22.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.905 178.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.688 ' HG ' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -51.72 -29.93 20.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.128 179.722 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.57 ' N ' HD23 ' A' ' 19' ' ' LEU . 76.2 m-70 -62.19 -37.51 85.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.021 0.439 . . . . 0.0 110.836 -179.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.531 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 4.3 mmpt? -94.5 16.85 14.29 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.034 -178.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -145.41 -20.12 0.48 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.624 ' HB2' ' CD1' ' A' ' 71' ' ' LEU . 0.6 OUTLIER -63.75 -27.66 69.35 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 119.719 -0.793 . . . . 0.0 110.959 -179.608 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.435 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 86.2 t60 -178.86 -53.13 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.889 0.376 . . . . 0.0 110.643 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 141.68 126.83 2.2 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.874 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 90.9 94.63 1.26 Allowed Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.107 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.82 -26.65 1.72 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.753 0.311 . . . . 0.0 110.591 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -53.8 -32.25 51.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.484 179.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -86.25 -42.37 13.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.329 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.663 ' HG ' HD23 ' A' ' 19' ' ' LEU . 1.5 tm? -62.05 -35.89 79.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.838 179.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.439 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 45.3 t60 -46.61 -35.35 5.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.404 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.61 -24.1 53.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.689 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.516 HG13 ' O ' ' A' ' 30' ' ' LEU . 2.7 p -91.87 -47.17 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.438 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.493 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 6.7 t70 -71.63 -23.98 61.79 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.086 179.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.439 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 11.3 t30 -54.33 -30.69 52.18 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.0 -32.21 71.6 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.851 178.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.438 ' HG ' HD22 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -75.39 -64.52 1.05 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.434 179.427 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.436 ' CG ' ' HA ' ' A' ' 35' ' ' ASN . 1.5 pt20 -47.08 -28.53 1.76 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.298 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -76.33 -28.36 56.87 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.91 0.386 . . . . 0.0 110.351 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.57 ' O ' HG12 ' A' ' 44' ' ' ILE . 78.6 t -75.92 -43.3 39.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.504 179.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.406 HG22 ' N ' ' A' ' 42' ' ' GLU . 4.7 tp -46.5 -33.11 1.84 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.13 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.056 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.559 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 1.6 mt-10 -75.57 -30.59 59.72 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.081 179.093 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.601 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 43.2 m-20 -82.79 -25.41 32.76 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.835 178.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 40' ' ' VAL . 17.1 mm -86.9 -53.05 10.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.098 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.559 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -64.58 -27.71 69.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.23 -179.657 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.511 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 25.9 t0 -86.63 -46.8 9.75 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 120.907 0.384 . . . . 0.0 110.501 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.601 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.5 m-30 -66.5 -23.24 66.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.567 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.8 -26.01 13.11 Favored 'General case' 0 C--N 1.334 -0.109 0 CA-C-O 120.888 0.375 . . . . 0.0 110.635 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -90.9 9.45 30.36 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.367 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.58 -2.15 58.75 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.694 -0.765 . . . . 0.0 113.082 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.36 -41.28 31.84 Favored Glycine 0 C--N 1.333 0.39 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.167 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.444 ' HA3' ' CE2' ' A' ' 47' ' ' PHE . . . -163.74 24.73 0.19 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.178 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.59 -168.32 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.883 0.373 . . . . 0.0 110.764 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 88.65 -62.02 3.76 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.77 -0.728 . . . . 0.0 113.041 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . -124.57 11.55 7.96 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.386 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.572 ' HE3' ' CD2' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -88.43 -44.23 10.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 117.034 0.417 . . . . 0.0 111.249 179.858 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.487 ' O ' ' CB ' ' A' ' 61' ' ' MET . 0.1 OUTLIER -59.32 -14.09 10.32 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.872 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 55' ' ' GLY . 27.1 pt20 -85.9 -50.62 6.96 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.34 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -85.87 -29.81 23.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.864 0.364 . . . . 0.0 110.655 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.425 ' CG ' ' HD3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -78.3 -31.78 49.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.995 179.796 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.487 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.1 OUTLIER -56.86 -40.47 76.21 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.489 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.97 -19.44 61.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.929 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -76.46 -31.86 58.06 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.543 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.482 ' CD2' ' HA ' ' A' ' 61' ' ' MET . 1.1 p90 -87.04 -25.86 24.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.88 0.371 . . . . 0.0 110.456 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -82.13 -30.96 30.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.417 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -58.48 -36.7 74.14 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.416 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.412 ' CG2' ' O ' ' A' ' 33' ' ' VAL . 83.4 t -54.19 -42.89 58.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.422 179.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.542 ' CD2' HG13 ' A' ' 85' ' ' ILE . 0.5 OUTLIER -74.09 -14.28 60.96 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.512 179.142 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.67 -52.19 53.53 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -57.65 -24.57 57.26 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.528 0.68 . . . . 0.0 109.709 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.688 HD11 ' HG ' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -70.45 -65.27 0.75 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.734 -1.121 . . . . 0.0 112.818 -178.826 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -46.53 -21.7 0.21 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.418 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.407 ' N ' ' C ' ' A' ' 71' ' ' LEU . 45.7 m-20 -83.56 -23.85 31.84 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.135 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.53 ' CB ' ' O ' ' A' ' 23' ' ' TRP . 44.1 m-70 -135.94 33.2 2.91 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 119.234 -0.986 . . . . 0.0 112.993 -179.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.513 ' CD1' HG23 ' A' ' 82' ' ' VAL . 0.0 OUTLIER -51.92 92.08 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 177.587 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.484 ' N ' ' O ' ' A' ' 74' ' ' HIS . 41.9 tp60 -64.3 69.14 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.55 -178.017 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 52.74 25.49 22.4 Favored Glycine 0 N--CA 1.453 -0.176 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.716 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -126.7 40.01 1.87 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.426 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.439 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -48.9 -31.47 7.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.638 0.256 . . . . 0.0 111.215 -179.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -58.25 -31.72 67.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.042 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.582 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.2 m -68.02 -74.56 0.12 Allowed 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.513 HG23 ' CD1' ' A' ' 75' ' ' LEU . 12.6 t -49.09 -40.93 13.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.95 179.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.489 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 7.0 m170 -49.33 -41.86 39.86 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.189 0.519 . . . . 0.0 109.776 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -76.27 -27.07 56.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.622 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.582 HG22 ' O ' ' A' ' 81' ' ' THR . 0.2 OUTLIER -85.25 -36.34 10.94 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.9 -179.865 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.489 ' CG ' ' HA ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -71.11 -45.82 62.89 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.164 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.04 -29.74 67.52 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.4 ' O ' ' CD1' ' A' ' 92' ' ' ILE . 1.8 m-80 -82.96 -67.61 0.77 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.505 179.147 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.46 ' HA ' ' HB ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -52.84 -47.83 51.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.511 -179.591 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.3 -29.26 70.31 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.28 -0.568 . . . . 0.0 109.662 179.647 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -90.78 -4.0 56.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.168 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.46 ' HB ' ' HA ' ' A' ' 89' ' ' ILE . 1.1 mp -78.58 -44.59 25.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.628 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -52.39 -29.19 22.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.536 179.149 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.628 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 38.1 t-80 -61.57 -65.36 0.7 Allowed 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.109 -179.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.9 m170 -62.44 -9.56 8.82 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.369 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 30.9 mt -89.3 -63.46 1.29 Allowed 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 120.956 0.408 . . . . 0.0 110.456 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -67.56 -12.25 59.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.219 179.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 94' ' ' HIS . 11.2 mm-40 -87.92 -26.42 22.72 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 120.912 0.386 . . . . 0.0 110.377 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.429 HD12 ' HB2' ' A' ' 5' ' ' LEU . 11.3 tp -66.83 -56.84 8.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.92 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 31.9 t -63.56 -39.94 87.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.423 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -60.9 -33.04 72.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.837 0.351 . . . . 0.0 111.006 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.838 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 112.84 -0.104 . . . . 0.0 112.84 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -63.2 -17.63 62.62 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.61 0.205 . . . . 0.0 111.105 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.41 ' CD2' HD12 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -51.17 -24.02 3.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.046 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.412 ' N ' ' CE ' ' A' ' 48' ' ' MET . 33.6 p-10 -59.61 -41.13 89.66 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.896 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -48.24 -32.59 7.4 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.22 0.533 . . . . 0.0 110.048 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -87.4 -30.3 20.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.295 179.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.403 ' O ' HD21 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -68.92 -34.94 76.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.359 179.799 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -52.96 -43.06 66.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.302 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.41 -41.31 28.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.927 0.394 . . . . 0.0 111.001 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.468 ' O ' HG12 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -57.36 -61.22 2.63 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.6 179.833 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.467 ' HA ' HD21 ' A' ' 16' ' ' LEU . 7.5 tm0? -51.28 -38.04 50.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.047 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -75.67 -28.47 58.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.905 179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.502 ' CG2' ' HA ' ' A' ' 85' ' ' ILE . 0.3 OUTLIER -68.18 -31.08 50.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.983 179.19 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.467 HD21 ' HA ' ' A' ' 13' ' ' GLN . 3.4 mm? -60.5 -37.38 80.92 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.207 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.2 ttpt -41.78 -41.91 2.48 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.033 0.444 . . . . 0.0 110.554 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.9 -43.77 67.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.759 178.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.644 ' HG ' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -50.42 -44.0 55.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.572 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.529 ' CE1' ' CD1' ' A' ' 30' ' ' LEU . 78.5 m-70 -49.33 -31.3 8.96 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.483 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 6.2 mmpt? -94.24 -9.86 34.79 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -177.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.481 ' HB2' ' CG2' ' A' ' 81' ' ' THR . 4.8 m120 -126.37 3.82 6.99 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -179.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.682 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -77.06 -54.05 7.03 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.752 179.833 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.504 ' N ' ' CG ' ' A' ' 23' ' ' TRP . 8.7 t-160 179.39 57.6 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.921 0.391 . . . . 0.0 111.027 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 118.21 -107.5 1.48 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.302 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -124.65 -146.2 6.81 Favored Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.167 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.454 ' CD ' ' CE1' ' A' ' 20' ' ' HIS . 17.3 ttpp -94.11 -11.13 31.18 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -50.41 -65.45 0.56 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -178.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -75.14 -25.39 58.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.567 0.222 . . . . 0.0 111.111 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.682 ' HB2' ' CD1' ' A' ' 23' ' ' TRP . 2.0 tm? -72.99 -29.15 62.82 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.437 ' N ' ' O ' ' A' ' 27' ' ' LYS . 28.3 t60 -47.71 -51.85 20.51 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.527 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.11 -22.48 66.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.887 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.469 ' CG1' ' CG1' ' A' ' 67' ' ' VAL . 1.2 t -85.82 -62.25 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.864 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.481 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 1.3 t0 -59.42 -25.26 64.18 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 1.3 m120 -56.41 -39.42 72.99 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 177.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.13 -45.85 83.39 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 177.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.477 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -53.51 -69.69 0.11 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.619 178.623 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -46.48 -43.55 16.79 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.038 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -54.99 -26.22 35.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.05 0.452 . . . . 0.0 110.243 179.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.505 ' O ' HG12 ' A' ' 44' ' ' ILE . 32.5 t -74.36 -57.52 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.374 179.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.579 HG22 ' N ' ' A' ' 42' ' ' GLU . 0.5 OUTLIER -44.49 -35.71 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.79 -179.766 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.623 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 3.8 pt-20 -75.64 -30.29 59.41 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.829 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.528 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 2.1 m-20 -84.08 -27.56 28.17 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.885 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.505 HG12 ' O ' ' A' ' 40' ' ' VAL . 25.3 mm -86.99 -48.43 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.497 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.623 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -68.96 -26.83 65.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.276 -179.631 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.524 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 14.0 t70 -86.48 -41.91 14.0 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.071 0.463 . . . . 0.0 110.226 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.528 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.4 m-85 -72.14 -23.72 61.34 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.606 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.429 ' CG ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -54.01 -34.6 60.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.981 179.752 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -73.77 -22.46 59.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.422 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 146.14 -11.8 1.61 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.428 -0.892 . . . . 0.0 113.082 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.36 -26.44 4.97 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.71 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 154.03 44.61 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.256 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.8 t -59.53 -29.65 68.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.731 0.3 . . . . 0.0 111.03 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.23 72.03 2.05 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.191 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.442 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . 149.03 -19.79 1.23 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.575 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.448 ' O ' ' CB ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.64 -46.01 9.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.663 0.268 . . . . 0.0 111.279 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.508 ' O ' ' CB ' ' A' ' 61' ' ' MET . 5.7 tp -61.79 -10.84 9.95 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 1.6 pp0? -85.88 -50.98 6.69 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.939 179.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -86.88 -30.8 21.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.997 0.427 . . . . 0.0 110.382 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.448 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -76.39 -29.52 57.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.616 179.637 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.508 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 2.9 tmm? -55.66 -44.69 77.47 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 121.015 0.436 . . . . 0.0 110.509 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -12.82 60.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.181 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -83.2 -24.75 32.28 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.535 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.469 ' CD2' ' O ' ' A' ' 61' ' ' MET . 1.6 p90 -87.08 -35.38 18.74 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.902 0.382 . . . . 0.0 110.427 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.458 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 0.0 OUTLIER -79.17 -30.97 43.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.96 179.757 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -58.92 -34.93 72.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.019 0.438 . . . . 0.0 110.407 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.477 ' CG2' ' HB2' ' A' ' 37' ' ' LEU . 80.5 t -57.65 -44.05 84.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.418 179.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.51 ' CD2' HG13 ' A' ' 85' ' ' ILE . 0.9 OUTLIER -70.44 -9.21 55.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.611 178.799 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -71.45 -57.99 3.92 Favored 'General case' 0 C--O 1.231 0.098 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.583 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 3.5 tp10 -53.38 -37.48 62.47 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.949 0.88 . . . . 0.0 108.996 177.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.644 HD11 ' HG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -70.86 -68.34 0.44 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.72 -1.582 . . . . 0.0 112.04 -179.32 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 22.5 t30 -49.3 -25.59 2.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.924 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -85.28 4.17 36.15 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.656 ' O ' ' N ' ' A' ' 76' ' ' GLN . 72.2 m-70 -150.9 32.03 0.62 Allowed 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.594 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -50.27 82.76 0.0 OUTLIER 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.912 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.656 ' N ' ' O ' ' A' ' 74' ' ' HIS . 4.5 tt0 -84.18 -34.32 24.0 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.675 -177.512 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -88.1 -20.34 49.91 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.7 -0.762 . . . . 0.0 113.009 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 130.82 130.24 3.16 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.256 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.594 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -52.76 -19.44 2.45 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -179.824 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -48.6 -39.24 23.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.696 0.284 . . . . 0.0 111.32 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.496 ' O ' HG23 ' A' ' 85' ' ' ILE . 1.2 m -69.55 -74.15 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 178.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.575 ' O ' ' N ' ' A' ' 86' ' ' GLU . 25.8 t -47.77 -36.8 5.5 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.414 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.084 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.484 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 57.0 t-80 -52.45 -41.08 62.97 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -76.17 -28.26 57.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.459 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.558 ' O ' ' HB ' ' A' ' 89' ' ' ILE . 0.2 OUTLIER -85.61 -33.15 7.45 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.196 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.054 -179.728 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.575 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -75.95 -44.69 38.74 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.059 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -60.85 -29.97 69.84 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.406 ' O ' ' CD1' ' A' ' 92' ' ' ILE . 2.0 m-80 -82.89 -63.19 1.41 Allowed 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.065 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.558 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -54.5 -48.51 69.79 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.186 179.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.416 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 0.1 OUTLIER -60.88 -29.55 69.62 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.6 179.658 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -90.8 -3.44 57.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.371 178.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.459 ' HB ' ' HA ' ' A' ' 89' ' ' ILE . 1.1 mp -78.65 -39.05 22.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.62 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -60.45 -25.07 65.72 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.25 178.689 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.62 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 8.9 t-80 -60.56 -65.91 0.61 Allowed 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.222 -179.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 63.7 m80 -63.67 -9.32 13.36 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.48 178.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 55.2 mt -89.48 -59.7 2.14 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.127 0.489 . . . . 0.0 110.543 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.417 ' HA ' ' CD2' ' A' ' 57' ' ' LEU . 5.4 mt-10 -66.61 -11.96 55.83 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.382 179.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.508 ' HB2' ' O ' ' A' ' 94' ' ' HIS . 8.8 tt0 -94.68 3.71 54.73 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.723 0.297 . . . . 0.0 111.111 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.429 ' CD2' ' CG ' ' A' ' 48' ' ' MET . 8.1 tp -101.66 -47.48 4.62 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.966 0.412 . . . . 0.0 110.669 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 41.2 t -76.89 -34.12 22.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.124 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -98.33 31.33 2.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.943 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.6 tpt85 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.958 179.98 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.508 ' HA2' ' HG3' ' A' ' 48' ' ' MET . . . . . . . . 0 N--CA 1.451 -0.301 0 CA-C-O 120.397 -0.113 . . . . 0.0 112.99 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.45 -18.62 61.68 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 116.654 0.227 . . . . 0.0 111.056 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.432 ' CD2' HD12 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -53.14 -21.76 5.42 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.061 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.405 ' CB ' ' HB2' ' A' ' 45' ' ' HIS . 38.5 p-10 -61.39 -40.18 93.4 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.815 179.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -51.38 -28.44 12.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.086 0.469 . . . . 0.0 110.012 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.421 ' CD1' HG13 ' A' ' 92' ' ' ILE . 0.5 OUTLIER -83.86 -29.38 27.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.002 179.22 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.408 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 10.3 mt -63.79 -30.61 71.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.049 0.452 . . . . 0.0 110.792 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -54.46 -51.28 65.52 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.549 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -51.25 -49.55 60.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.885 0.374 . . . . 0.0 111.33 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.468 ' HG ' ' N ' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -56.51 -60.82 2.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.615 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.515 ' HA ' HD23 ' A' ' 16' ' ' LEU . 2.4 tt0 -53.85 -35.28 61.31 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.037 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -77.98 -26.03 48.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.228 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.446 ' CG2' ' HA ' ' A' ' 85' ' ' ILE . 0.5 OUTLIER -70.5 -27.56 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.401 179.314 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.515 HD23 ' HA ' ' A' ' 13' ' ' GLN . 3.0 mm? -61.1 -36.66 80.28 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.313 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.555 ' HA ' ' CD2' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -48.68 -40.54 28.52 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.105 0.479 . . . . 0.0 110.096 179.478 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.92 -39.17 76.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.515 178.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.625 ' HG ' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -55.74 -53.53 55.45 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.842 -179.662 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.561 ' CA ' ' HG ' ' A' ' 30' ' ' LEU . 2.2 p80 -53.93 -15.44 1.37 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -178.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.616 ' HA ' ' CE ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -92.85 -24.12 18.59 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.674 -179.815 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -130.8 28.71 4.82 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.832 0.349 . . . . 0.0 111.061 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.548 ' CB ' HD11 ' A' ' 71' ' ' LEU . 2.4 p-90 -88.99 -31.84 17.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.739 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.482 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 79.7 t60 -177.9 -52.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.652 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 168.04 120.19 0.51 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.568 -0.825 . . . . 0.0 113.105 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 61.97 128.51 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.838 179.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.428 ' HD2' ' CD2' ' A' ' 20' ' ' HIS . 7.6 tttt -64.11 -16.26 61.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.597 0.237 . . . . 0.0 110.917 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -44.94 -48.98 11.34 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.483 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -77.44 -39.45 46.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.482 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.561 ' HG ' ' CA ' ' A' ' 20' ' ' HIS . 1.8 tm? -59.81 -28.2 67.25 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.425 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 1.4 t60 -46.39 -58.73 3.47 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.306 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.43 -21.88 60.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.746 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.535 ' CG1' HG13 ' A' ' 67' ' ' VAL . 2.2 t -83.41 -65.26 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.846 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.444 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 1.3 t0 -61.37 -25.03 66.89 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.369 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.425 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 16.2 t-20 -58.77 -41.15 85.92 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 177.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.419 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -64.72 -46.95 80.09 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 177.171 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.446 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -51.44 -68.48 0.17 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.945 178.521 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -46.66 -41.77 15.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.133 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -59.25 -26.54 64.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.24 179.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.447 ' O ' HG13 ' A' ' 44' ' ' ILE . 14.9 t -70.92 -52.89 24.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.404 179.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.412 ' CD1' HD11 ' A' ' 37' ' ' LEU . 1.8 mp -46.07 -38.64 3.13 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.535 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.608 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 1.5 pt-20 -72.91 -28.74 62.65 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 120.747 0.308 . . . . 0.0 110.802 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.564 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 6.0 m-20 -84.14 -28.31 27.53 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.49 HD13 HG23 ' A' ' 44' ' ' ILE . 34.3 mt -86.56 -52.48 11.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.335 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.608 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -63.27 -26.76 68.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.727 -179.943 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.513 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 13.5 t70 -86.68 -36.68 18.59 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.026 0.441 . . . . 0.0 110.01 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.564 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.2 m-85 -74.22 -42.1 60.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.28 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.508 ' HG3' ' HA2' ' A' ' 3' ' ' GLY . 12.1 ptp -51.73 -24.09 5.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.331 -179.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -88.71 9.29 24.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.516 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 111.27 20.36 7.1 Favored Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.991 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -96.45 26.95 19.3 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.706 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.87 29.82 7.08 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.608 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.31 -12.92 59.37 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.514 0.19 . . . . 0.0 111.514 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -83.16 71.63 2.98 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.668 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.407 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . 131.1 -9.45 5.68 Favored Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.803 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.49 ' HE3' ' CG ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -88.51 -34.38 17.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.668 0.27 . . . . 0.0 111.295 -179.749 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.511 ' O ' ' CB ' ' A' ' 61' ' ' MET . 0.1 OUTLIER -65.51 -11.58 44.77 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -179.197 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 55' ' ' GLY . 15.1 pt20 -86.47 -50.03 7.17 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.547 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 71.4 mt-10 -85.54 -31.02 22.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.835 0.35 . . . . 0.0 110.783 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.448 ' CG ' ' HD3' ' A' ' 56' ' ' LYS . 0.8 OUTLIER -78.11 -33.09 50.75 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.902 179.768 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.511 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 4.5 tmm? -55.37 -39.17 69.77 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.562 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.84 -17.27 62.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.967 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.434 ' HB3' HG22 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -78.95 -31.36 45.05 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.624 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.433 ' CZ ' HG23 ' A' ' 92' ' ' ILE . 0.8 OUTLIER -87.27 -24.49 24.34 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.192 0.52 . . . . 0.0 109.597 179.351 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -83.02 -33.39 26.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.164 178.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -55.48 -38.44 69.12 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.904 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.535 HG13 ' CG1' ' A' ' 33' ' ' VAL . 3.9 t -51.57 -44.39 33.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.109 0.48 . . . . 0.0 110.285 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.51 ' HA ' HD22 ' A' ' 71' ' ' LEU . 0.9 OUTLIER -68.4 -6.71 26.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.003 179.302 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -75.85 -59.89 2.56 Favored 'General case' 0 C--N 1.338 0.092 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.449 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -48.44 -40.7 27.04 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 122.391 1.091 . . . . 0.0 108.564 177.447 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.625 HD11 ' HG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -70.74 -68.12 0.45 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 112.904 -1.953 . . . . 0.0 112.029 -179.421 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -51.15 -26.08 6.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.346 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -87.91 9.21 22.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.265 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.491 ' O ' ' N ' ' A' ' 76' ' ' GLN . 14.2 m-70 -158.68 35.63 0.22 Allowed 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.482 ' CD1' HG21 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -54.67 88.44 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.198 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 74' ' ' HIS . 3.6 tp60 -63.76 69.25 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.384 -178.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.439 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 57.11 30.68 61.0 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.401 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -130.62 39.12 1.84 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.587 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -49.47 -32.03 11.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.697 0.284 . . . . 0.0 111.26 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -63.18 -31.53 72.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.135 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.489 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.9 m -67.49 -72.57 0.16 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.908 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 86' ' ' GLU . 42.9 t -51.48 -39.1 21.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.852 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.491 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.3 OUTLIER -46.6 -41.23 14.21 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 179.226 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -76.27 -29.73 57.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.729 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.506 HG12 ' HA ' ' A' ' 82' ' ' VAL . 0.2 OUTLIER -85.38 -30.44 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.106 -179.675 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.3 OUTLIER -79.76 -46.51 16.86 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.929 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 1.7 mp0 -59.59 -27.51 66.34 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 177.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.663 ' O ' HD11 ' A' ' 92' ' ' ILE . 1.6 m-80 -82.71 -69.17 0.65 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.811 178.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.493 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -49.84 -39.39 15.01 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.445 -179.964 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.504 ' O ' ' CD2' ' A' ' 93' ' ' PHE . 28.5 mmmt -63.54 -23.55 67.43 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 119.89 -0.724 . . . . 0.0 110.002 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -90.54 -8.75 49.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.177 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.663 HD11 ' O ' ' A' ' 88' ' ' ASN . 1.2 mp -78.75 -56.31 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.977 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.504 ' CD2' ' O ' ' A' ' 90' ' ' LYS . 0.6 OUTLIER -45.72 -44.56 13.75 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.726 179.669 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.485 ' N ' ' CG ' ' A' ' 93' ' ' PHE . 9.3 t-160 -57.52 -61.43 2.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.789 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -61.54 -11.97 13.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.502 178.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 18.7 mt -89.18 -65.55 1.01 Allowed 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.972 0.415 . . . . 0.0 110.599 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -65.71 -13.31 59.03 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.114 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.478 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 4.4 tp10 -87.07 -26.94 23.44 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-O 120.938 0.399 . . . . 0.0 110.306 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.432 HD12 ' CD2' ' A' ' 5' ' ' LEU . 18.8 tp -66.19 -57.74 6.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.634 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 33.5 t -64.15 -37.66 80.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.21 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -60.91 -43.15 98.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.896 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.852 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.562 ' HA2' ' HG3' ' A' ' 48' ' ' MET . . . . . . . . 0 N--CA 1.452 -0.298 0 N-CA-C 112.726 -0.15 . . . . 0.0 112.726 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.4 tptm -63.85 -17.43 63.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.481 0.181 . . . . 0.0 111.044 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.428 ' HB2' HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -52.38 -22.9 5.12 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.198 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.424 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 26.3 p-10 -56.95 -46.38 82.16 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.02 179.266 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -49.43 -32.16 11.2 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.089 0.471 . . . . 0.0 110.209 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -87.85 -26.65 22.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.384 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 1.0 OUTLIER -74.41 -40.94 61.68 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.748 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -49.3 -42.05 40.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.638 -179.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -50.41 -42.32 53.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.129 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.504 ' O ' HG13 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -59.57 -62.53 1.81 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.678 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.438 ' HA ' HD22 ' A' ' 16' ' ' LEU . 4.0 tt0 -51.17 -35.45 36.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.977 -179.339 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -77.39 -30.92 53.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.953 179.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.504 HG13 ' O ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -63.68 -32.48 57.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.831 179.033 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.481 ' N ' HG12 ' A' ' 15' ' ' VAL . 3.6 mm? -59.45 -36.52 76.1 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.396 179.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.9 ttpt -43.02 -42.55 3.89 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.038 0.447 . . . . 0.0 110.291 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -70.35 -44.96 67.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.7 178.673 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.63 ' HG ' HD12 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -48.03 -41.49 25.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.421 -179.969 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.511 ' CB ' ' HE3' ' A' ' 21' ' ' LYS . 50.0 m-70 -51.69 -35.01 41.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.927 -179.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.511 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.0 mmpt? -92.34 1.81 57.01 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -177.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -142.1 10.64 1.95 Allowed 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.385 -0.526 . . . . 0.0 112.323 -179.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.691 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -81.53 -36.88 28.64 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.809 179.734 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.482 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 86.3 t60 -179.99 -52.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.877 0.37 . . . . 0.0 110.672 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 154.71 149.72 5.34 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.536 -0.84 . . . . 0.0 113.046 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.13 103.66 0.01 OUTLIER Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.555 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -54.14 -23.01 12.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.756 0.313 . . . . 0.0 110.696 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.73 -32.97 21.15 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.858 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -85.27 -47.57 9.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.453 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.691 ' HB2' ' CD1' ' A' ' 23' ' ' TRP . 2.2 tm? -59.53 -29.69 68.07 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.416 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 0.4 OUTLIER -45.75 -56.45 5.29 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.685 179.738 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.92 -20.24 63.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.932 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.472 HG11 ' CG1' ' A' ' 67' ' ' VAL . 1.3 t -87.34 -62.75 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.762 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.487 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -60.99 -24.91 66.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.93 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.416 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 1.5 t30 -58.64 -39.87 81.76 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 177.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.402 ' O ' ' CG2' ' A' ' 40' ' ' VAL . 0.2 OUTLIER -61.68 -51.47 68.29 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.588 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.478 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -53.94 -68.12 0.21 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.965 178.651 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 14.6 tm0? -46.81 -40.08 13.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.741 -179.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -69.01 -22.96 64.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.965 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.402 ' CG2' ' O ' ' A' ' 36' ' ' HIS . 66.5 t -78.33 -38.83 23.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.485 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.413 HG22 ' N ' ' A' ' 42' ' ' GLU . 1.1 tp -48.1 -34.64 4.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.412 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.413 ' N ' HG22 ' A' ' 41' ' ' ILE . 4.0 pt-20 -75.69 -37.33 59.62 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 120.967 0.413 . . . . 0.0 109.902 179.197 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.524 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -62.47 -30.59 71.36 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.637 178.768 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.459 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -86.85 -35.26 8.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.581 179.128 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.404 ' CD2' ' O ' ' A' ' 41' ' ' ILE . 23.5 m170 -70.19 -42.12 72.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.738 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.25 -21.76 53.23 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.998 178.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.524 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.3 m-85 -88.64 -45.25 10.0 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.985 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.562 ' HG3' ' HA2' ' A' ' 3' ' ' GLY . 14.6 ptt? -49.79 -24.76 2.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.723 0.297 . . . . 0.0 111.488 -179.492 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 mm100 -90.61 15.29 11.23 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.534 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 102.54 26.13 7.39 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.867 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -104.07 31.51 8.58 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.649 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.35 23.94 7.76 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.769 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 55.0 p -59.74 -20.2 55.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.673 0.273 . . . . 0.0 111.408 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -93.5 76.69 1.1 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.417 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.438 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . 135.53 -12.28 4.3 Favored Glycine 0 N--CA 1.453 -0.184 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.365 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.5 ' O ' ' HB3' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.4 -53.31 4.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.909 0.385 . . . . 0.0 110.593 179.589 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.487 ' O ' ' CB ' ' A' ' 61' ' ' MET . 0.5 OUTLIER -54.48 -11.52 0.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.224 -179.553 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -85.53 -51.89 6.2 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.162 179.845 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.98 -26.96 23.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.951 0.405 . . . . 0.0 110.251 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.5 ' HB3' ' O ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -77.67 -36.53 51.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.273 179.464 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.487 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 1.4 tmt? -50.4 -39.12 46.12 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.911 0.386 . . . . 0.0 110.705 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.89 -22.17 66.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.206 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.4 -42.4 53.85 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -179.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.443 ' HE1' HG23 ' A' ' 89' ' ' ILE . 1.0 OUTLIER -73.52 -24.53 60.16 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.121 0.486 . . . . 0.0 110.157 -179.989 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -82.77 -31.96 28.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.081 178.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -37.24 74.43 Favored 'General case' 0 C--O 1.231 0.079 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.674 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.478 ' CG2' ' HB2' ' A' ' 37' ' ' LEU . 84.9 t -54.29 -39.49 43.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.474 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.525 ' CD2' HG13 ' A' ' 85' ' ' ILE . 1.0 OUTLIER -75.84 -4.88 43.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.524 178.651 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -76.04 -56.81 4.31 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.565 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 7.9 tp10 -53.38 -38.04 62.99 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 122.098 0.951 . . . . 0.0 108.536 177.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.63 HD12 ' HG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -72.77 -67.17 0.58 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 113.485 -1.689 . . . . 0.0 111.939 -179.402 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.424 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 23.2 t-20 -50.68 -26.04 5.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.447 -179.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 21.9 m-20 -87.68 7.77 28.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.517 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.514 ' O ' ' N ' ' A' ' 76' ' ' GLN . 72.9 m-70 -154.09 31.92 0.44 Allowed 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.454 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -50.32 90.27 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.289 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -66.25 68.85 0.06 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.417 -177.997 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 58.44 24.78 56.81 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.75 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -130.96 46.23 1.09 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.236 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.454 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.2 OUTLIER -55.41 -32.5 62.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.693 0.283 . . . . 0.0 111.296 -179.697 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 37.4 p-80 -57.47 -33.43 67.97 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.052 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.597 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.2 m -67.15 -74.36 0.12 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.497 ' CG1' ' CD2' ' A' ' 71' ' ' LEU . 29.1 t -50.66 -42.06 21.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.2 179.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.478 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 42.4 t60 -48.83 -41.09 31.81 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.406 ' O ' ' HB3' ' A' ' 88' ' ' ASN . 84.7 t60 -76.47 -27.58 56.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.752 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.597 HG22 ' O ' ' A' ' 81' ' ' THR . 0.2 OUTLIER -85.48 -33.1 7.48 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.149 -179.63 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.481 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -74.38 -45.71 45.1 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 179.102 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.415 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -59.14 -29.9 67.75 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 177.943 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.462 ' ND2' ' N ' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -83.08 -58.63 2.77 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.494 179.344 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.503 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -60.57 -48.13 89.88 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.359 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.396 -179.313 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.414 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 0.6 OUTLIER -61.5 -29.11 69.77 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 120.124 -0.631 . . . . 0.0 109.818 179.784 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -90.68 -2.41 57.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.196 178.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.445 ' O ' ' HG ' ' A' ' 96' ' ' LEU . 0.9 OUTLIER -77.82 -42.58 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.229 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.64 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -55.95 -27.95 54.76 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.13 178.842 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.64 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 16.9 t60 -62.39 -64.15 1.01 Allowed 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.25 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -63.35 -9.86 13.99 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.127 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 32.7 mt -89.25 -63.37 1.3 Allowed 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.905 0.384 . . . . 0.0 110.317 179.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -63.36 -13.95 44.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.011 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -85.16 -28.7 25.32 Favored 'General case' 0 N--CA 1.458 -0.05 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.553 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.428 HD13 ' HB2' ' A' ' 5' ' ' LEU . 18.8 tp -62.66 -53.93 47.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.845 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 38.9 t -71.68 -27.84 29.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.36 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -94.83 33.57 1.46 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.142 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.911 179.851 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.805 -0.118 . . . . 0.0 112.805 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -59.13 -17.32 25.73 Favored 'General case' 0 CA--C 1.514 -0.412 0 O-C-N 122.825 -0.221 . . . . 0.0 111.136 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.46 -24.73 3.31 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 22.4 p-10 -57.95 -41.3 82.57 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.68 178.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -50.26 -30.99 12.99 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.179 0.514 . . . . 0.0 109.88 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -84.96 -30.46 24.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.091 179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 15.5 mt -63.56 -34.36 77.64 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.563 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.77 -42.18 67.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.269 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.43 -46.81 69.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.945 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.542 ' HG ' ' N ' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -58.31 -60.48 3.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.677 179.995 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.542 ' N ' ' HG ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -52.59 -36.44 56.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.082 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -77.1 -29.91 55.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.249 -0.432 . . . . 0.0 109.901 179.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.497 ' CG2' ' HA ' ' A' ' 85' ' ' ILE . 0.5 OUTLIER -64.09 -26.86 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.855 178.871 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.509 ' O ' HD21 ' A' ' 19' ' ' LEU . 2.5 mm? -63.35 -35.91 81.96 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.694 178.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -42.98 -35.06 1.11 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.244 0.545 . . . . 0.0 110.076 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -78.38 -49.92 12.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.064 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.539 HD23 ' CD2' ' A' ' 20' ' ' HIS . 0.0 OUTLIER -47.37 -43.64 23.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.468 -179.885 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.539 ' CD2' HD23 ' A' ' 19' ' ' LEU . 30.1 m170 -49.49 -36.5 23.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.913 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.429 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 4.2 mmpt? -90.21 4.66 49.92 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.426 ' ND2' ' HA3' ' A' ' 78' ' ' GLY . 9.8 m120 -148.61 18.59 1.03 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.998 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.668 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -88.05 -52.7 5.11 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.39 179.316 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.539 ' N ' ' CG ' ' A' ' 23' ' ' TRP . 10.6 t-160 179.94 52.1 0.0 OUTLIER 'General case' 0 C--O 1.232 0.153 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.223 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 70.63 120.62 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.255 0 N-CA-C 115.205 0.842 . . . . 0.0 115.205 177.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.78 130.02 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 115.207 -0.496 . . . . 0.0 114.321 177.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.447 ' HG3' ' CD2' ' A' ' 20' ' ' HIS . 3.5 ttpt -68.05 -14.85 63.29 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.398 -0.401 . . . . 0.0 110.023 178.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -46.79 -47.64 20.85 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.47 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -75.68 -46.98 28.21 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.801 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.668 ' HB2' ' CD1' ' A' ' 23' ' ' TRP . 0.3 OUTLIER -58.47 -28.02 64.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.004 0.43 . . . . 0.0 109.993 179.223 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.442 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 1.2 t60 -45.66 -48.76 14.87 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.451 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.09 -31.14 71.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.246 0.546 . . . . 0.0 110.142 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.52 HG13 ' HA ' ' A' ' 67' ' ' VAL . 2.4 t -72.32 -62.43 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.742 179.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.53 -21.57 64.37 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.307 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.442 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 0.6 OUTLIER -60.13 -41.18 92.14 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 177.312 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.419 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.3 OUTLIER -64.69 -49.74 69.76 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 177.205 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.482 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -51.92 -67.15 0.27 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.763 178.505 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.28 -42.88 10.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.812 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.9 m-20 -58.25 -30.32 66.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.031 179.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.442 ' N ' ' O ' ' A' ' 37' ' ' LEU . 21.7 t -65.19 -50.31 74.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.162 179.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 12.5 mm -44.24 -41.15 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.758 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.612 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 0.5 OUTLIER -72.65 -29.89 63.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.703 0.287 . . . . 0.0 111.018 -179.743 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.546 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.3 OUTLIER -84.32 -26.39 28.53 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 178.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 40' ' ' VAL . 6.4 mm -87.3 -50.57 13.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.353 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.612 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -67.21 -26.95 66.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.353 -179.597 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.524 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 9.9 t0 -86.48 -40.87 14.87 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 121.039 0.447 . . . . 0.0 110.054 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.546 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.4 m-85 -73.72 -25.41 60.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.442 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.449 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -50.62 -39.11 49.39 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.001 0.429 . . . . 0.0 110.83 179.466 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -67.04 -25.29 66.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.757 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 130.12 -3.41 5.95 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.894 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.91 -36.32 26.68 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.141 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.411 ' HA3' ' CD2' ' A' ' 47' ' ' PHE . . . -162.56 25.13 0.22 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 121.054 -0.594 . . . . 0.0 112.178 179.597 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.89 -175.87 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.899 0.38 . . . . 0.0 110.98 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 50.02 59.7 7.27 Favored Glycine 0 CA--C 1.517 0.217 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.66 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 147.9 -19.76 1.43 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.624 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.446 ' O ' ' CB ' ' A' ' 60' ' ' MET . 3.6 pptp? -88.18 -41.28 13.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.778 0.323 . . . . 0.0 111.023 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.52 ' O ' ' CB ' ' A' ' 61' ' ' MET . 14.1 tp -65.55 -9.72 28.86 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.884 -179.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -86.3 -49.41 7.7 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.826 179.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -87.31 -31.17 20.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.439 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.446 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 1.3 tpt -77.54 -30.82 52.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.845 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.52 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -56.24 -43.0 78.22 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.265 179.678 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.79 -20.18 63.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.02 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -74.29 -29.42 61.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.464 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.469 ' CE2' ' HG2' ' A' ' 61' ' ' MET . 1.4 p90 -87.08 -28.97 22.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.962 0.411 . . . . 0.0 110.682 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.46 ' CG ' ' CE1' ' A' ' 64' ' ' PHE . 4.1 mt-30 -81.23 -34.14 32.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.92 179.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 9.0 tm0? -56.58 -35.13 67.85 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.855 0.36 . . . . 0.0 110.787 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.52 ' HA ' HG13 ' A' ' 33' ' ' VAL . 9.5 t -55.62 -49.11 76.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.327 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.53 ' HG ' HD23 ' A' ' 71' ' ' LEU . 1.2 mp -65.1 -10.85 33.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.738 179.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -69.54 -59.86 2.7 Favored 'General case' 0 N--CA 1.458 -0.068 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.483 ' CG ' ' CZ3' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -48.91 -40.91 31.83 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 122.232 1.015 . . . . 0.0 109.198 177.769 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.537 HD12 ' HG ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -69.99 -67.78 0.46 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 113.313 -1.767 . . . . 0.0 112.207 -179.279 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -49.24 -30.0 6.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.033 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -87.4 9.4 20.79 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.628 0.232 . . . . 0.0 111.628 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.507 ' O ' ' N ' ' A' ' 76' ' ' GLN . 85.4 m-70 -151.98 27.89 0.61 Allowed 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.486 ' CD1' HG23 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -51.38 89.34 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 178.32 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.507 ' N ' ' O ' ' A' ' 74' ' ' HIS . 3.9 mm-40 -66.36 68.09 0.06 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.19 -178.352 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.36 46.56 86.72 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.66 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.426 ' HA3' ' ND2' ' A' ' 22' ' ' ASN . . . -152.21 39.39 0.76 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.502 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.477 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -46.89 -39.73 12.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.716 0.293 . . . . 0.0 111.332 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 31.7 t60 -47.99 -33.57 8.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.55 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.55 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.3 m -67.97 -73.53 0.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.262 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 86' ' ' GLU . 25.3 t -50.15 -40.31 17.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.037 179.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.49 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 10.3 t60 -48.91 -41.14 32.61 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -76.61 -28.87 56.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.801 178.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.55 HG22 ' O ' ' A' ' 81' ' ' THR . 0.2 OUTLIER -85.28 -31.16 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.137 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.012 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -76.01 -48.41 21.13 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.568 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.77 -30.06 60.64 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 177.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -83.08 -59.52 2.45 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.676 179.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.51 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -60.96 -50.32 81.05 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.882 -179.323 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 1.3 mptp? -61.43 -29.09 69.72 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.878 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -90.69 0.13 57.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.982 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.514 ' O ' ' HG ' ' A' ' 96' ' ' LEU . 0.8 OUTLIER -78.67 -45.01 25.66 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.031 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.637 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -53.05 -26.35 15.59 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.081 178.419 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.637 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.7 OUTLIER -60.29 -64.22 1.03 Allowed 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.296 -179.365 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.8 m-70 -66.02 -9.52 31.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.351 178.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 34.9 mt -89.17 -58.16 2.64 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 120.944 0.402 . . . . 0.0 110.442 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.68 -10.93 60.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.061 178.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -90.7 -12.99 35.01 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.969 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.449 ' CD2' ' HG3' ' A' ' 48' ' ' MET . 4.5 tp -87.11 -56.58 3.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.002 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 45.9 t -62.98 -46.03 97.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.273 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -60.04 -30.03 68.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.011 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.145 -0.931 . . . . 0.0 110.857 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 CA-C-O 120.41 -0.105 . . . . 0.0 113.068 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -82.31 -21.63 36.0 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 116.856 0.328 . . . . 0.0 110.971 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.456 ' CD2' HD12 ' A' ' 99' ' ' LEU . 0.2 OUTLIER -51.26 -21.98 2.46 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.371 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.432 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 8.5 t30 -62.46 -40.41 96.54 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.789 178.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -50.44 -30.12 11.83 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.226 0.536 . . . . 0.0 109.745 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -85.67 -27.71 25.19 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.953 178.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 13.4 mt -70.83 -13.06 61.9 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.092 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -75.4 -42.21 54.27 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.805 0.336 . . . . 0.0 111.322 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -56.53 -48.17 77.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.186 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.477 ' CB ' HG12 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -54.78 -58.84 5.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.632 -179.874 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.475 ' N ' ' HG ' ' A' ' 12' ' ' LEU . 1.4 tt0 -52.38 -35.54 51.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.955 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.87 -28.18 49.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.973 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.457 HG11 ' HB ' ' A' ' 85' ' ' ILE . 0.5 OUTLIER -67.64 -26.8 36.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.196 179.286 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.468 HD11 HD11 ' A' ' 19' ' ' LEU . 2.4 mm? -62.85 -36.15 82.28 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.247 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.414 ' HA ' ' CE ' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -46.66 -40.27 12.85 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.047 0.451 . . . . 0.0 109.933 179.397 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.46 ' O ' HG21 ' A' ' 81' ' ' THR . 0.6 OUTLIER -68.21 -41.01 81.94 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.241 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.532 ' HG ' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -57.22 -38.37 73.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.737 179.534 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.523 ' HA ' ' HG ' ' A' ' 30' ' ' LEU . 39.8 m-70 -51.68 -34.84 40.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.853 0.359 . . . . 0.0 111.144 179.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.509 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.7 mmpt? -94.15 2.36 55.97 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -178.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -139.54 5.75 2.24 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -179.548 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.563 ' CD1' ' CD2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -80.47 -37.11 32.47 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.109 179.41 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.467 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 86.0 t60 -176.75 -49.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.736 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 146.86 132.38 2.31 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.102 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 80.48 101.25 0.31 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.522 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.84 -25.45 7.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.753 0.311 . . . . 0.0 110.451 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.81 -31.48 49.28 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.432 179.475 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -85.25 -42.88 14.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.343 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.563 ' CD2' ' CD1' ' A' ' 23' ' ' TRP . 1.2 tm? -62.76 -34.72 77.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.923 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.444 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 33.7 t-80 -47.74 -39.49 17.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.214 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -76.59 -21.89 54.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.676 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.538 HG13 ' O ' ' A' ' 30' ' ' LEU . 1.6 p -91.66 -46.73 14.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.716 -0.22 . . . . 0.0 111.254 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.501 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 2.7 t70 -72.97 -27.16 61.65 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.264 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.444 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 1.1 t30 -53.94 -32.68 54.48 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 178.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -63.73 -34.36 77.69 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.287 178.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.413 HD21 ' HB2' ' A' ' 64' ' ' PHE . 0.1 OUTLIER -71.3 -66.3 0.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.195 179.202 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -47.37 -35.69 8.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.015 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -70.16 -31.71 69.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.229 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.45 ' O ' HG13 ' A' ' 44' ' ' ILE . 49.5 t -71.49 -36.9 62.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.213 179.257 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 35.2 mm -49.79 -35.42 10.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.851 179.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.569 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -75.64 -25.39 56.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.202 179.326 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 3.3 m-20 -82.19 -27.24 32.73 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.621 178.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 40' ' ' VAL . 0.1 OUTLIER -87.08 -52.71 11.33 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.121 179.321 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.569 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -62.13 -27.31 68.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.707 0.289 . . . . 0.0 110.701 -179.733 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.51 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 11.7 t0 -86.83 -32.55 20.23 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.087 0.47 . . . . 0.0 110.161 179.446 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.568 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.3 m-85 -81.6 -45.87 15.21 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.703 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 11.5 ptp -50.23 -24.4 2.84 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.446 -179.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -89.92 13.14 15.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.628 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 104.73 25.94 6.65 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.787 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -102.14 27.01 22.28 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.561 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 101.78 27.34 7.13 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.543 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.89 -15.73 62.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.659 0.266 . . . . 0.0 111.35 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.82 73.26 2.59 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.61 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 131.92 -12.43 5.33 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.635 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.417 ' O ' ' CB ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.39 -28.14 21.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.612 0.244 . . . . 0.0 110.956 -179.881 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.51 ' O ' ' CB ' ' A' ' 61' ' ' MET . 0.4 OUTLIER -70.16 -9.2 54.92 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 121.021 -0.272 . . . . 0.0 111.722 -179.679 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.402 ' CG ' ' N ' ' A' ' 59' ' ' GLU . 15.1 pt20 -86.77 -50.81 6.48 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.615 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.402 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 0.4 OUTLIER -86.22 -31.74 21.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.802 -179.726 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.417 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -78.39 -30.8 48.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.098 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.51 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -59.37 -41.75 90.05 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.316 179.708 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -60.78 -19.47 59.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.576 179.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -74.26 -31.35 62.52 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.508 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.453 ' CE2' ' HG2' ' A' ' 61' ' ' MET . 1.0 OUTLIER -87.41 -26.37 23.33 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.01 0.433 . . . . 0.0 109.891 179.608 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -82.51 -32.2 28.83 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.877 178.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -59.03 -33.62 70.95 Favored 'General case' 0 C--O 1.23 0.063 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.488 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.458 HG12 HG12 ' A' ' 33' ' ' VAL . 87.9 t -54.96 -38.35 45.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.178 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.547 ' HA ' HD23 ' A' ' 71' ' ' LEU . 1.8 mp -74.98 -7.55 53.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.513 178.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -74.31 -59.45 2.72 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.434 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 6.8 tp10 -51.67 -34.48 38.48 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 122.029 0.919 . . . . 0.0 108.786 177.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.555 HD11 ' CB ' ' A' ' 23' ' ' TRP . 0.3 OUTLIER -72.53 -65.78 0.74 Allowed 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 113.613 -1.631 . . . . 0.0 111.806 -179.418 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.434 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 15.1 t-20 -51.18 -24.27 4.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.851 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -85.14 2.78 42.08 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -179.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.578 ' O ' ' N ' ' A' ' 76' ' ' GLN . 2.4 m-70 -151.53 36.34 0.57 Allowed 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.677 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.555 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -52.08 86.55 0.0 OUTLIER 'General case' 0 C--O 1.231 0.119 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.733 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.578 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -79.16 -39.17 34.14 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.485 -177.399 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -101.1 25.15 29.36 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 120.505 -0.855 . . . . 0.0 114.077 -178.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 88.8 127.32 2.9 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.855 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.555 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -50.46 -19.97 1.01 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.606 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -40.86 -38.16 0.9 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.749 0.309 . . . . 0.0 111.615 -179.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.46 HG21 ' O ' ' A' ' 18' ' ' ASN . 1.3 m -69.48 -73.34 0.16 Allowed 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 178.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.58 ' HA ' HG12 ' A' ' 85' ' ' ILE . 41.8 t -47.39 -37.02 4.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.975 179.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.516 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -50.52 -41.46 53.75 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.1 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -76.43 -27.9 56.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.537 178.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.58 HG12 ' HA ' ' A' ' 82' ' ' VAL . 0.2 OUTLIER -84.07 -33.98 9.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.731 179.972 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.582 ' O ' ' HB2' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -74.31 -51.7 14.43 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 178.939 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.412 ' HA ' ' NE2' ' A' ' 87' ' ' GLN . 3.0 mm-40 -54.16 -28.19 38.61 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.245 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.664 ' O ' HD11 ' A' ' 92' ' ' ILE . 2.2 m-80 -83.01 -67.12 0.81 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.08 178.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.516 ' O ' ' HB ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -50.46 -33.45 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.528 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.582 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 0.9 OUTLIER -67.75 -24.82 65.39 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.717 -0.793 . . . . 0.0 109.609 179.798 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -86.88 -4.95 59.23 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.075 178.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.664 HD11 ' O ' ' A' ' 88' ' ' ASN . 1.7 mp -78.47 -57.86 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 179.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.489 ' CD1' ' C ' ' A' ' 93' ' ' PHE . 0.2 OUTLIER -46.12 -44.79 16.0 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.561 178.958 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.48 ' N ' ' CG ' ' A' ' 93' ' ' PHE . 1.1 t60 -57.92 -61.4 2.56 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.958 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -61.44 -12.19 13.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.526 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.659 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 20.3 mt -89.25 -65.47 1.01 Allowed 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.927 0.394 . . . . 0.0 110.494 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -64.12 -14.07 52.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.201 179.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.432 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 3.5 tp10 -86.7 -24.98 25.01 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.559 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.456 HD12 ' CD2' ' A' ' 5' ' ' LEU . 7.5 tp -70.46 -57.14 5.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.626 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.3 t -60.09 -28.47 41.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.18 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -96.08 32.99 1.8 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.136 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.862 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.244 0 CA-C-O 120.417 -0.102 . . . . 0.0 113.007 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.407 ' CE ' ' HA ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -60.44 -18.83 53.63 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 116.807 0.303 . . . . 0.0 111.38 -179.727 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.482 ' CD2' HD23 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -52.84 -20.99 3.69 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.352 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.407 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 24.4 p-10 -54.3 -44.71 72.21 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.362 178.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -53.83 -29.43 40.92 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.401 ' HB3' HD11 ' A' ' 5' ' ' LEU . 1.5 tm? -87.41 -28.61 22.04 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.782 178.649 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.433 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 10.7 mt -60.11 -35.67 75.76 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 121.179 0.514 . . . . 0.0 109.85 179.372 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -55.37 -37.7 67.87 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.153 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.2 -53.01 39.07 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.965 0.412 . . . . 0.0 110.725 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.534 ' HG ' ' N ' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -54.78 -57.1 12.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.322 179.55 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.534 ' N ' ' HG ' ' A' ' 12' ' ' LEU . 31.0 tt0 -52.18 -36.48 51.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.795 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.57 -30.66 57.13 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.479 ' CG2' ' HA ' ' A' ' 85' ' ' ILE . 0.5 OUTLIER -62.81 -26.23 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.828 178.753 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.484 HD22 ' HA ' ' A' ' 13' ' ' GLN . 3.2 mm? -65.52 -32.77 74.55 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.539 178.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.447 ' HA ' ' HD1' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -44.18 -37.11 2.96 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.232 0.539 . . . . 0.0 110.146 179.131 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -77.4 -49.21 15.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.986 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.575 ' HG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -43.22 -49.33 6.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.818 -179.88 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.526 ' CD2' HD11 ' A' ' 30' ' ' LEU . 41.0 m80 -48.21 -40.54 24.66 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -179.244 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.449 ' HE3' ' HB2' ' A' ' 20' ' ' HIS . 2.8 mmpt? -87.25 7.61 27.73 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -177.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.415 ' ND2' ' OG1' ' A' ' 81' ' ' THR . 70.0 m-80 -153.93 19.25 0.51 Allowed 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.315 -0.554 . . . . 0.0 112.195 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.643 ' CZ3' ' HG3' ' A' ' 70' ' ' GLU . 0.5 OUTLIER -87.05 -33.7 19.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.986 0.422 . . . . 0.0 110.08 178.972 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.489 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 3.7 t60 -177.15 -51.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.579 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 160.26 130.26 1.11 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.464 -0.874 . . . . 0.0 113.12 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.68 120.39 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.74 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.412 ' HD2' ' CG ' ' A' ' 20' ' ' HIS . 18.8 tttt -62.22 -18.64 61.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.651 0.262 . . . . 0.0 110.771 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -50.25 -41.01 49.51 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.98 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -77.86 -49.49 14.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.491 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.641 ' HB2' ' CD1' ' A' ' 23' ' ' TRP . 1.4 tm? -56.42 -30.23 62.55 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.449 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.3 OUTLIER -45.79 -43.96 13.63 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.995 179.993 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.64 -26.23 64.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.081 0.467 . . . . 0.0 110.54 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.469 HG13 HD12 ' A' ' 30' ' ' LEU . 2.3 t -83.5 -62.29 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.888 179.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.46 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 0.6 OUTLIER -58.5 -23.05 57.03 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.333 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.449 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 0.7 OUTLIER -59.73 -41.08 90.11 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 177.77 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.422 ' HB2' ' O ' ' A' ' 33' ' ' VAL . 0.8 OUTLIER -62.69 -49.48 74.94 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 177.485 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.481 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -56.15 -68.71 0.18 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.571 178.358 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -47.13 -43.86 21.07 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.27 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -61.24 -27.99 68.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.551 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.411 ' O ' HG13 ' A' ' 44' ' ' ILE . 68.0 t -76.0 -41.48 38.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.557 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.416 ' CD1' HD23 ' A' ' 12' ' ' LEU . 25.9 mm -47.91 -36.8 5.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.164 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.576 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -71.8 -29.1 64.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.433 179.646 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.562 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 13.7 m-20 -84.19 -27.27 28.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.931 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.531 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 1.8 mt -86.85 -52.77 11.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.188 179.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.576 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -62.7 -28.12 69.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.237 -179.782 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.52 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 39.0 t0 -86.77 -38.68 16.66 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 120.961 0.41 . . . . 0.0 110.316 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.562 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.2 m-85 -77.68 -24.01 49.41 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.711 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.474 ' HB2' ' O ' ' A' ' 44' ' ' ILE . 0.8 OUTLIER -52.41 -36.98 55.56 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 121.093 0.473 . . . . 0.0 110.502 179.482 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -71.67 -11.22 60.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.124 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 118.62 20.78 4.13 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.752 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -86.37 27.56 5.64 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.44 -0.886 . . . . 0.0 111.954 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 115.7 27.39 3.05 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.121 -0.561 . . . . 0.0 112.12 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.4 t -85.76 36.51 0.66 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.753 0.311 . . . . 0.0 111.611 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -107.1 -32.89 3.36 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.586 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.407 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . -135.62 7.95 4.26 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.986 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.531 ' HE3' ' HA ' ' A' ' 44' ' ' ILE . 0.0 OUTLIER -88.6 -41.14 12.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.983 0.42 . . . . 0.0 111.375 179.959 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.497 ' O ' ' CB ' ' A' ' 61' ' ' MET . 49.8 tp -60.26 -11.68 7.01 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.817 -0.628 . . . . 0.0 112.289 -178.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 1.7 pp0? -86.24 -50.31 7.06 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.657 -0.417 . . . . 0.0 111.202 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.97 -32.23 20.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.827 0.346 . . . . 0.0 110.454 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.476 ' HG2' ' NZ ' ' A' ' 56' ' ' LYS . 29.9 tpp -75.73 -29.78 59.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.473 179.564 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.497 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 3.0 ttt -52.58 -40.74 62.93 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.905 0.383 . . . . 0.0 110.312 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.6 tptt -63.07 -24.21 67.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.857 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -70.28 -30.88 68.02 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.385 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.482 ' CE2' ' HG3' ' A' ' 61' ' ' MET . 0.8 OUTLIER -86.96 -30.04 21.59 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.085 0.469 . . . . 0.0 110.228 179.866 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -82.4 -31.62 29.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.568 179.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -59.36 -37.16 77.18 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.786 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.481 ' CG2' ' HB2' ' A' ' 37' ' ' LEU . 3.9 t -53.39 -42.75 49.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.434 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.519 ' HG ' HD22 ' A' ' 71' ' ' LEU . 0.8 OUTLIER -70.76 -7.09 42.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.858 179.306 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -73.37 -55.96 5.69 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.643 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 2.6 tp10 -53.69 -38.01 63.8 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 122.018 0.913 . . . . 0.0 108.885 177.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.575 HD13 ' HG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -75.05 -70.82 0.39 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 113.686 -1.597 . . . . 0.0 112.283 -178.928 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.409 ' OD1' ' N ' ' A' ' 73' ' ' ASN . 8.0 p-10 -49.32 -27.38 3.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.608 -179.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.409 ' N ' ' OD1' ' A' ' 72' ' ' ASN . 2.9 t-20 -91.69 13.65 17.48 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.271 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.467 ' O ' ' N ' ' A' ' 76' ' ' GLN . 63.0 m-70 -151.96 24.31 0.66 Allowed 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.441 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.4 OUTLIER -47.63 94.74 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.887 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.467 ' N ' ' O ' ' A' ' 74' ' ' HIS . 9.9 tp60 -59.39 -61.61 2.5 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.34 -177.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.4 31.78 0.44 Allowed Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.235 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -141.15 49.36 0.78 Allowed Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.804 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.441 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -48.63 -27.52 2.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.716 0.293 . . . . 0.0 110.882 179.623 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -67.5 -26.92 66.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.954 179.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.602 ' O ' HG21 ' A' ' 85' ' ' ILE . 1.2 m -68.04 -75.1 0.11 Allowed 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 179.274 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.565 ' O ' ' N ' ' A' ' 86' ' ' GLU . 21.3 t -48.3 -42.95 11.84 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.765 179.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.501 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 1.8 t60 -47.93 -42.05 26.29 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.226 0.536 . . . . 0.0 109.797 179.235 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.3 m80 -76.44 -28.42 56.58 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.675 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.602 HG21 ' O ' ' A' ' 81' ' ' THR . 0.1 OUTLIER -85.48 -29.99 6.46 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.178 -179.616 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -76.75 -46.82 23.78 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 178.869 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -60.67 -27.91 68.2 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.4 ' O ' ' CD1' ' A' ' 92' ' ' ILE . 1.7 m-80 -83.05 -58.31 2.91 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.263 178.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.525 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -62.17 -47.99 90.55 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.287 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.32 -179.739 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -61.69 -28.37 69.35 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.042 -0.663 . . . . 0.0 109.724 179.735 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -90.56 -1.26 57.88 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.09 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.468 ' O ' ' HG ' ' A' ' 96' ' ' LEU . 0.9 OUTLIER -78.64 -44.09 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.287 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.638 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -55.06 -27.0 41.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.137 178.585 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.638 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 2.6 t-160 -62.75 -59.8 4.38 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.853 -179.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.434 ' O ' ' HG2' ' A' ' 98' ' ' GLU . 38.9 m170 -67.3 -11.03 56.53 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.189 178.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 36.6 mt -90.0 -56.97 3.02 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.004 0.431 . . . . 0.0 110.818 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -65.23 -10.63 33.46 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.472 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 95' ' ' HIS . 14.2 pt-20 -81.97 -28.07 32.87 Favored 'General case' 0 N--CA 1.461 0.091 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.508 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.482 HD23 ' CD2' ' A' ' 5' ' ' LEU . 1.7 mt -69.43 -64.05 0.95 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.183 0.516 . . . . 0.0 110.639 179.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.77 -26.58 35.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.012 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -85.39 -35.15 21.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.775 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.405 ' CB ' ' O ' ' A' ' 98' ' ' GLU . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.141 -0.933 . . . . 0.0 110.873 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 CA-C-O 120.415 -0.103 . . . . 0.0 112.892 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.8 tpmt? -84.12 -17.73 39.14 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 116.765 0.282 . . . . 0.0 110.649 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.44 ' HB2' HD12 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -53.79 -20.63 5.96 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 177.985 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.412 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 35.5 p-10 -61.2 -42.6 98.87 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.677 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -49.43 -29.47 6.54 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.17 0.509 . . . . 0.0 109.802 179.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.42 ' CD1' ' O ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -84.39 -34.46 23.57 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.067 179.038 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.8 mt -64.07 -29.56 70.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.082 0.468 . . . . 0.0 110.598 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.63 -49.94 64.14 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.337 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -54.52 -46.07 73.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.881 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.601 ' HA ' HG13 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -54.53 -61.0 2.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.491 179.747 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.466 ' HA ' HD22 ' A' ' 16' ' ' LEU . 4.9 tt0 -52.76 -37.42 59.42 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.617 -179.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.41 -30.26 53.47 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.035 0.445 . . . . 0.0 110.052 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.601 HG13 ' HA ' ' A' ' 12' ' ' LEU . 0.9 OUTLIER -64.96 -27.48 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.104 178.984 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.531 HD12 HD12 ' A' ' 85' ' ' ILE . 2.6 mm? -61.63 -39.69 92.19 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 178.291 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.3 ttpt -39.14 -39.55 0.6 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.005 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.481 ' C ' HG23 ' A' ' 81' ' ' THR . 7.4 m-20 -66.01 -55.68 15.47 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.419 -0.809 . . . . 0.0 108.982 178.018 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.584 ' HB2' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -39.47 -47.57 1.86 Allowed 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 114.561 -1.2 . . . . 0.0 111.969 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.563 ' CB ' ' HE3' ' A' ' 21' ' ' LYS . 42.6 m-70 -50.64 -37.03 38.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.563 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.6 mmpt? -94.23 8.37 42.0 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -177.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.454 ' HB2' ' CG2' ' A' ' 81' ' ' THR . 35.0 m120 -152.69 10.14 0.48 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.143 -0.623 . . . . 0.0 112.57 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.568 ' CD1' ' CD2' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -75.16 -34.71 61.62 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.846 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.479 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 81.7 t60 -178.41 -50.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.672 178.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -130.88 -91.68 0.57 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.027 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -136.11 -142.52 4.51 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.888 -0.672 . . . . 0.0 111.785 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.8 tttm -93.62 -18.53 22.08 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.612 0.244 . . . . 0.0 111.125 179.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -54.66 -56.31 20.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.804 0.335 . . . . 0.0 110.928 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -79.96 -17.41 53.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.021 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.568 ' CD2' ' CD1' ' A' ' 23' ' ' TRP . 1.2 tm? -80.9 -31.74 35.06 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.038 0.447 . . . . 0.0 109.936 179.455 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -51.47 -36.91 46.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.116 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -76.57 -25.22 53.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.505 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.492 HG13 ' O ' ' A' ' 30' ' ' LEU . 1.5 p -90.35 -42.71 14.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.062 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.498 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 1.2 t0 -73.13 -31.77 64.5 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 179.11 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -51.97 -29.55 21.08 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -72.69 -36.41 67.87 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.344 -0.844 . . . . 0.0 109.408 178.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.439 ' HA ' HG21 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -68.45 -66.81 0.52 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.38 179.267 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -45.39 -36.0 3.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.307 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -65.99 -31.07 71.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.943 0.402 . . . . 0.0 110.39 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.576 ' O ' HG12 ' A' ' 44' ' ' ILE . 32.6 t -64.55 -53.86 37.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.8 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.485 ' CG2' ' CE1' ' A' ' 45' ' ' HIS . 38.3 mm -38.1 -42.35 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.935 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -71.7 -39.68 70.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.793 0.33 . . . . 0.0 110.405 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.484 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.7 OUTLIER -71.72 -28.64 63.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.549 179.399 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.576 HG12 ' O ' ' A' ' 40' ' ' VAL . 7.1 mm -86.83 -40.53 14.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.867 0.365 . . . . 0.0 110.686 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.485 ' CE1' ' CG2' ' A' ' 41' ' ' ILE . 13.7 m170 -73.87 -39.01 64.26 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.345 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -74.38 -26.09 59.89 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.484 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.6 m-85 -88.61 -46.19 9.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.979 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.415 ' HE3' ' N ' ' A' ' 5' ' ' LEU . 8.4 ptm -46.49 -32.38 3.29 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.84 0.352 . . . . 0.0 111.406 -179.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -26.57 66.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.244 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 146.52 -13.75 1.59 Allowed Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.599 -0.81 . . . . 0.0 113.009 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.73 -42.65 37.13 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.86 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 168.69 39.2 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.607 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 7.8 p -59.35 -24.38 63.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.735 0.302 . . . . 0.0 111.032 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.95 57.93 4.02 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.298 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 171.14 -28.1 0.11 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.937 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.449 ' HE3' ' CD1' ' A' ' 44' ' ' ILE . 0.6 OUTLIER -87.94 -30.04 20.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.921 0.361 . . . . 0.0 110.974 -179.866 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.503 ' O ' ' CB ' ' A' ' 61' ' ' MET . 12.8 tp -61.53 -10.92 8.97 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.046 -0.261 . . . . 0.0 111.602 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.421 ' CG ' ' N ' ' A' ' 59' ' ' GLU . 13.4 pt20 -85.75 -49.86 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.751 -0.38 . . . . 0.0 110.798 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.421 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 19.7 mm-40 -87.42 -33.8 18.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.133 0.492 . . . . 0.0 110.295 179.342 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.421 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 3.5 tpt -74.6 -27.19 60.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.834 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.503 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 3.9 ttp -58.48 -47.61 83.49 Favored 'General case' 0 C--O 1.231 0.086 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.013 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -62.28 -24.51 67.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.512 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -67.8 -32.29 72.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.318 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.49 ' CD1' ' C ' ' A' ' 64' ' ' PHE . 0.9 OUTLIER -86.99 -33.47 19.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.888 0.375 . . . . 0.0 110.511 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.404 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 10.2 tt0 -80.76 -32.8 35.41 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.997 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.66 -33.09 71.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.768 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.427 HG23 ' HB2' ' A' ' 37' ' ' LEU . 95.1 t -58.46 -44.32 88.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.57 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.521 ' HA ' ' HB3' ' A' ' 71' ' ' LEU . 1.3 mp -73.21 -6.37 45.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.78 179.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -73.1 -54.37 8.68 Favored 'General case' 0 N--CA 1.457 -0.122 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.499 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 5.3 tp10 -57.95 -31.72 67.12 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.881 0.848 . . . . 0.0 108.967 177.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.584 HD11 ' HB2' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -76.98 -72.04 0.37 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.905 -1.498 . . . . 0.0 112.378 -178.8 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -51.45 -26.13 7.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.46 -179.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -86.45 8.15 22.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.166 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.527 ' O ' ' N ' ' A' ' 76' ' ' GLN . 36.5 m-70 -146.41 29.46 1.05 Allowed 'General case' 0 CA--C 1.523 -0.094 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.51 HD22 ' HB ' ' A' ' 82' ' ' VAL . 0.3 OUTLIER -49.93 88.9 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.236 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 74' ' ' HIS . 1.4 tm0? -62.37 -48.75 78.38 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.94 0.4 . . . . 0.0 110.76 -178.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -172.54 34.91 0.13 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.334 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.43 ' HA3' ' ND2' ' A' ' 22' ' ' ASN . . . -142.55 49.77 0.73 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.659 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.456 ' HD2' ' N ' ' A' ' 79' ' ' LYS . 0.0 OUTLIER -45.5 -36.26 4.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.618 0.246 . . . . 0.0 111.246 179.952 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 36.0 m80 -59.72 -40.78 89.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.605 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.512 ' O ' HG21 ' A' ' 85' ' ' ILE . 1.4 m -59.28 -64.47 0.93 Allowed 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.939 179.118 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.809 ' HA ' ' CG2' ' A' ' 85' ' ' ILE . 9.5 t -60.05 -49.29 84.6 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.093 -179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.521 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 1.4 m-70 -50.77 -40.23 54.48 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.946 -0.301 . . . . 0.0 110.773 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 -75.41 -56.4 4.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.909 0.385 . . . . 0.0 110.28 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.809 ' CG2' ' HA ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -58.33 -32.98 46.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.751 179.477 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.576 ' CG ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -81.16 -39.87 24.85 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.638 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.521 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 1.1 mp0 -66.79 -25.94 66.71 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 177.12 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.415 ' O ' ' CD1' ' A' ' 92' ' ' ILE . 1.4 m-80 -82.65 -52.96 6.31 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.746 178.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.563 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -66.18 -50.49 68.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.932 179.843 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.402 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 0.3 OUTLIER -56.96 -27.31 61.07 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 120.43 -0.508 . . . . 0.0 109.991 -179.855 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -90.7 -5.34 55.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.354 178.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.469 ' O ' ' HG ' ' A' ' 96' ' ' LEU . 1.0 OUTLIER -78.6 -46.2 24.97 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 179.38 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.622 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.2 OUTLIER -48.53 -28.92 3.69 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.348 178.976 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.622 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.5 OUTLIER -60.12 -62.99 1.46 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.102 -179.518 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -68.07 -8.72 40.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.345 178.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 23.0 mt -88.52 -56.17 3.42 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.995 0.426 . . . . 0.0 110.009 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.402 ' HA ' ' CD2' ' A' ' 57' ' ' LEU . 0.4 OUTLIER -71.63 -9.81 58.81 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.824 178.486 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -88.16 -30.5 19.74 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.514 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.44 HD12 ' HB2' ' A' ' 5' ' ' LEU . 10.8 tp -67.6 -56.07 10.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.918 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.2 t -62.2 -37.99 79.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.417 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -63.73 -39.22 93.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.938 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.874 179.94 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.4 mtm . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.747 0.308 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -59.97 121.78 12.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.693 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.439 ' HA2' ' HB3' ' A' ' 48' ' ' MET . . . -179.5 -38.3 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.553 -0.832 . . . . 0.0 112.788 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.0 tptt -62.97 -17.42 62.04 Favored 'General case' 0 CA--C 1.513 -0.455 0 O-C-N 122.809 -0.23 . . . . 0.0 111.327 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.88 -23.43 7.07 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.005 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 39.4 p-10 -61.25 -39.69 91.27 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.851 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -50.13 -29.61 9.48 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.079 0.466 . . . . 0.0 110.185 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -87.66 -29.35 21.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.281 179.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.1 mt -67.74 -35.54 78.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.563 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -51.78 -47.8 64.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.664 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -49.16 -46.29 45.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.26 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.466 ' HG ' ' N ' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -55.46 -58.71 6.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.762 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.466 ' N ' ' HG ' ' A' ' 12' ' ' LEU . 40.2 tt0 -55.16 -37.73 67.37 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.336 -179.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -76.41 -26.46 55.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.87 0.367 . . . . 0.0 110.175 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.508 ' CG2' ' HA ' ' A' ' 85' ' ' ILE . 0.5 OUTLIER -69.87 -27.28 32.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.345 179.31 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.46 HD21 ' HA ' ' A' ' 13' ' ' GLN . 2.7 mm? -62.63 -40.39 96.83 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.179 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -41.24 -39.74 1.43 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.069 0.462 . . . . 0.0 110.54 179.519 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -70.7 -47.04 61.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.528 178.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.578 ' HG ' HD12 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -47.67 -40.81 20.88 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.392 179.806 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.535 ' CE1' ' CD1' ' A' ' 30' ' ' LEU . 63.5 m-70 -52.48 -39.29 61.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.908 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.525 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 3.9 mmpt? -86.88 5.07 38.7 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -177.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.1 m-20 -152.97 19.93 0.58 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.745 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.653 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 0.8 OUTLIER -84.84 -31.17 23.95 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.645 179.156 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.475 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 84.6 t60 -178.44 -52.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.541 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.23 -87.0 0.3 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.94 -0.647 . . . . 0.0 111.827 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -136.15 -145.52 5.07 Favored Glycine 0 N--CA 1.442 -0.931 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.605 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.416 ' HD2' ' CE1' ' A' ' 20' ' ' HIS . 1.2 ttpt -94.1 -20.88 19.5 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.603 0.24 . . . . 0.0 111.339 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -52.29 -53.85 38.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.557 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -79.41 -27.21 41.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.317 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.653 ' HB2' ' CD1' ' A' ' 23' ' ' TRP . 2.1 tm? -75.24 -29.28 60.18 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.408 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.1 OUTLIER -49.05 -38.29 23.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.653 179.909 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -75.91 -23.57 55.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.715 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.482 HG11 ' CG1' ' A' ' 67' ' ' VAL . 0.9 OUTLIER -87.26 -58.16 3.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.831 179.764 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.49 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -59.32 -24.23 63.14 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.898 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.412 ' O ' ' HB2' ' A' ' 39' ' ' ASN . 1.0 OUTLIER -56.67 -44.3 81.28 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 177.816 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -57.82 -49.61 76.08 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 177.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.479 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -57.4 -66.64 0.43 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.591 178.536 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.415 ' O ' HG22 ' A' ' 41' ' ' ILE . 0.3 OUTLIER -46.46 -41.99 14.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.684 -179.59 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 35' ' ' ASN . 2.1 t-20 -68.52 -26.02 65.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.875 0.369 . . . . 0.0 110.615 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.45 ' O ' HG13 ' A' ' 44' ' ' ILE . 53.8 t -77.32 -37.71 25.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.525 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.415 HG22 ' O ' ' A' ' 38' ' ' GLN . 4.8 tp -48.17 -37.31 7.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 120.995 0.426 . . . . 0.0 110.664 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -75.67 -41.21 54.47 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.699 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -60.53 -30.23 69.62 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 40' ' ' VAL . 4.0 mt -86.54 -41.93 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.886 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 25.8 m170 -62.44 -43.97 97.54 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.273 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -73.89 -11.22 60.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.076 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.48 ' CD1' ' C ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -85.43 -42.03 14.87 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.76 179.781 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.439 ' HB3' ' HA2' ' A' ' 3' ' ' GLY . 1.6 tpp -45.73 -27.74 0.88 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.925 -179.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.86 19.96 10.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.788 0.328 . . . . 0.0 111.763 -179.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 75.85 33.16 51.79 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.644 -0.788 . . . . 0.0 113.121 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -95.19 40.24 2.71 Favored Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 109.961 -1.255 . . . . 0.0 109.961 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 123.11 21.29 2.59 Favored Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 114.503 -0.849 . . . . 0.0 111.015 -178.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.442 ' HA ' ' CD1' ' A' ' 47' ' ' PHE . 33.4 p -61.36 166.09 4.17 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.088 0.471 . . . . 0.0 111.433 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 51.36 51.38 37.1 Favored Glycine 0 N--CA 1.452 -0.284 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.909 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.403 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . 171.61 -33.83 0.14 Allowed Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.288 -0.958 . . . . 0.0 113.192 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.579 ' HD3' ' N ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -88.41 -26.19 22.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.874 0.337 . . . . 0.0 111.689 -179.491 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.579 ' N ' ' HD3' ' A' ' 56' ' ' LYS . 19.7 tp -70.12 -8.14 47.2 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.575 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' A' ' 55' ' ' GLY . 17.3 pt20 -86.39 -49.88 7.31 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.924 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.4 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 3.8 mt-10 -86.88 -34.1 19.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.447 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.457 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 8.7 tpp -74.22 -29.51 61.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.551 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.508 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 5.9 ttm -56.06 -50.74 70.12 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.978 0.418 . . . . 0.0 110.138 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -59.52 -20.87 58.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.824 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.83 -33.2 68.28 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.043 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.469 ' CE2' ' HG3' ' A' ' 61' ' ' MET . 1.1 p90 -84.08 -25.81 29.5 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 120.983 0.42 . . . . 0.0 110.068 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -35.33 27.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.256 178.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.08 -32.44 61.95 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.445 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.482 ' CG1' HG11 ' A' ' 33' ' ' VAL . 96.3 t -58.84 -38.74 74.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.005 179.154 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.517 ' CD2' HG13 ' A' ' 85' ' ' ILE . 0.7 OUTLIER -78.62 -4.33 48.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.233 178.453 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -76.41 -56.74 4.35 Favored 'General case' 0 CA--C 1.521 -0.14 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.597 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 3.1 tp10 -54.02 -36.62 63.2 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.99 0.9 . . . . 0.0 108.674 177.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.578 HD12 ' HG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -74.73 -69.64 0.45 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 113.553 -1.658 . . . . 0.0 112.168 -179.223 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -50.16 -26.14 4.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.633 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -87.27 7.82 26.86 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.428 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.499 ' O ' ' N ' ' A' ' 76' ' ' GLN . 5.7 m-70 -155.38 34.51 0.37 Allowed 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.456 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -51.23 90.34 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.105 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.029 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.499 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -65.64 68.3 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.536 -177.965 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 57.45 29.67 60.87 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.646 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -136.86 46.14 1.04 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.476 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.456 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.7 OUTLIER -52.67 -38.99 61.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.751 0.31 . . . . 0.0 111.224 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -49.58 -32.45 12.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.568 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.533 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.2 m -69.03 -74.16 0.13 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.505 ' HA ' HG12 ' A' ' 85' ' ' ILE . 22.6 t -49.46 -39.19 13.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.914 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.465 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.3 OUTLIER -49.02 -41.51 34.97 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 179.234 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -76.43 -28.92 56.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.694 178.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.533 HG22 ' O ' ' A' ' 81' ' ' THR . 0.2 OUTLIER -85.57 -33.41 7.68 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.346 -179.579 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.502 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -74.43 -43.06 57.91 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 179.115 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -62.49 -29.33 70.46 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -82.92 -57.05 3.47 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.443 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.48 ' O ' ' HB ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -63.51 -51.15 74.15 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.347 -179.675 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.426 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 5.8 mmtp -59.15 -27.53 65.73 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.119 -0.632 . . . . 0.0 109.782 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -90.72 -2.22 57.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.146 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.529 ' O ' ' HG ' ' A' ' 96' ' ' LEU . 0.9 OUTLIER -78.44 -46.62 25.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.339 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.639 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -52.5 -27.56 16.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.41 178.927 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.639 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.2 OUTLIER -65.16 -64.06 0.95 Allowed 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.661 -179.586 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -11.51 10.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.993 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 24.7 mt -89.34 -65.39 1.02 Allowed 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 120.949 0.404 . . . . 0.0 110.587 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.404 ' N ' HD23 ' A' ' 57' ' ' LEU . 25.4 tt0 -64.16 -14.24 53.78 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.176 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 11.2 tt0 -83.33 -24.87 31.94 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.524 179.488 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 31.4 tp -70.82 -61.48 1.75 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.744 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 22.7 t -65.56 -31.58 54.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.137 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -100.46 32.8 2.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.99 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.915 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.7 ttm . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.812 0.339 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.413 ' CE2' ' OXT' ' A' ' 102' ' ' ARG . 96.1 m-85 -96.96 40.88 1.13 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.823 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -118.54 -24.2 3.22 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.863 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.7 tptm -63.8 -15.62 59.2 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.705 0.252 . . . . 0.0 111.232 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.522 ' HG ' HD11 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -54.17 -22.15 10.59 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.861 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.449 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 20.5 p-10 -54.41 -45.24 72.92 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.649 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.16 -33.63 19.68 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.296 0.57 . . . . 0.0 109.539 178.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.406 ' HB3' HD13 ' A' ' 5' ' ' LEU . 1.7 tm? -87.85 -30.46 20.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.01 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.456 ' HG ' HD21 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -65.89 -38.09 87.84 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.082 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -50.51 -40.76 52.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.229 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -47.07 -42.17 18.28 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.075 0.464 . . . . 0.0 110.485 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.486 ' O ' HG13 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -57.31 -61.14 2.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.268 179.234 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.472 ' HA ' HD23 ' A' ' 16' ' ' LEU . 1.1 tm0? -50.63 -38.49 46.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.054 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.81 -31.04 61.6 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.486 HG13 ' O ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -64.97 -29.85 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.735 178.85 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.553 HD11 HD12 ' A' ' 19' ' ' LEU . 3.2 mm? -63.84 -28.43 69.85 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.092 178.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.493 ' HA ' ' HD1' ' A' ' 20' ' ' HIS . 0.2 OUTLIER -48.95 -40.97 32.41 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-O 121.155 0.502 . . . . 0.0 110.041 179.364 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -72.41 -45.67 58.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.79 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.57 HD11 ' HB2' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -43.93 -49.25 8.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.592 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.501 ' CD2' ' CD1' ' A' ' 30' ' ' LEU . 43.9 m80 -45.79 -39.38 8.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.098 -179.328 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.453 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 4.3 mmpt? -91.17 6.62 44.36 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -177.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.42 ' HB2' ' CG2' ' A' ' 81' ' ' THR . 3.0 m-80 -146.5 10.84 1.11 Allowed 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.497 -0.481 . . . . 0.0 112.279 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.62 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -82.07 -35.31 28.8 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.789 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.45 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 85.7 t60 -179.13 -51.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.009 0.433 . . . . 0.0 110.726 179.518 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -134.59 -93.72 0.47 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.903 -0.665 . . . . 0.0 111.747 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -129.13 -148.03 6.5 Favored Glycine 0 N--CA 1.44 -1.081 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.42 ' HD3' ' CE1' ' A' ' 31' ' ' HIS . 7.9 ttmt -94.35 -15.72 24.13 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.626 0.25 . . . . 0.0 111.476 179.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -55.91 -52.28 64.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.862 0.363 . . . . 0.0 111.027 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -81.97 -28.57 32.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.598 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.62 ' HB2' ' CD1' ' A' ' 23' ' ' TRP . 1.4 tm? -70.59 -32.24 69.54 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 178.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.42 ' CE1' ' HD3' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -44.51 -55.12 5.36 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.051 179.904 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -20.41 62.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.117 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.492 ' CG1' ' CG1' ' A' ' 67' ' ' VAL . 1.0 OUTLIER -90.01 -60.25 2.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.716 179.799 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.498 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -62.88 -25.62 68.39 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.182 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.412 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 10.8 t-20 -54.7 -37.72 66.15 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 177.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.15 -49.61 66.81 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.475 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -53.09 -67.74 0.23 Allowed 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.824 178.595 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -46.25 -43.18 15.32 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.262 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -63.73 -24.09 67.63 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.761 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.484 ' O ' HG13 ' A' ' 44' ' ' ILE . 50.8 t -70.55 -56.02 12.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.695 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.445 HG13 ' NE2' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -44.27 -39.75 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.965 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.445 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 3.3 pt-20 -71.15 -32.37 68.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.342 . . . . 0.0 110.404 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.557 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -79.04 -27.04 43.12 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.766 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 40' ' ' VAL . 20.6 mt -86.92 -26.11 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.109 178.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.445 ' NE2' HG13 ' A' ' 41' ' ' ILE . 20.3 m170 -77.88 -57.5 3.77 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.865 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.28 -25.66 67.25 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.072 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.557 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.9 m-85 -88.98 -28.13 20.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.665 179.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.9 ttt -49.46 -28.56 5.43 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.583 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -29.62 43.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.063 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 129.85 -6.3 6.13 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.905 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.45 -29.78 7.66 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.144 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.437 ' HA3' ' CE2' ' A' ' 47' ' ' PHE . . . -157.73 23.0 0.41 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.287 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.5 p -59.97 165.5 3.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.815 0.341 . . . . 0.0 110.543 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 66.46 51.13 44.97 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.531 -0.842 . . . . 0.0 111.995 -179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 161.19 -24.07 0.24 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.42 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.456 ' O ' ' CB ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -84.27 -43.19 15.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.682 0.277 . . . . 0.0 111.134 179.854 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.533 ' O ' ' CB ' ' A' ' 61' ' ' MET . 14.3 tp -65.21 -9.66 25.3 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -86.44 -50.34 6.95 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.793 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -87.33 -31.73 20.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.894 0.378 . . . . 0.0 110.594 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.456 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -78.19 -28.01 48.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.089 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.533 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.5 OUTLIER -59.32 -41.45 89.09 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.071 179.656 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -71.15 -15.73 62.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.083 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.415 ' HB3' HG21 ' A' ' 40' ' ' VAL . 0.9 OUTLIER -80.96 -25.93 36.99 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.273 -179.81 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.496 ' CD1' ' C ' ' A' ' 64' ' ' PHE . 1.2 p90 -86.91 -33.82 19.59 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 121.03 0.443 . . . . 0.0 110.039 179.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.455 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 10.5 tt0 -79.14 -35.67 41.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.731 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.6 tp60 -54.06 -33.5 57.63 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.969 0.414 . . . . 0.0 110.477 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.492 ' CG1' ' CG1' ' A' ' 33' ' ' VAL . 71.8 t -59.41 -39.5 79.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.217 179.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.57 ' HG ' HD22 ' A' ' 71' ' ' LEU . 0.5 OUTLIER -76.19 -5.67 47.82 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.394 178.68 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -75.68 -56.87 4.27 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.468 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 0.5 OUTLIER -53.57 -38.12 63.58 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 122.143 0.973 . . . . 0.0 108.674 177.594 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.57 HD22 ' HG ' ' A' ' 68' ' ' LEU . 0.3 OUTLIER -72.41 -67.36 0.56 Allowed 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 113.434 -1.712 . . . . 0.0 111.848 -179.345 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.408 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 65.9 t30 -51.04 -26.08 5.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.508 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -88.11 9.38 22.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.367 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.502 ' O ' ' N ' ' A' ' 76' ' ' GLN . 73.0 m-70 -154.97 32.31 0.4 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 111.768 0.284 . . . . 0.0 111.768 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.465 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -52.67 88.31 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.086 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.502 ' N ' ' O ' ' A' ' 74' ' ' HIS . 1.2 mm-40 -67.97 69.7 0.13 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.441 . . . . 0.0 111.171 -178.281 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 60.88 21.57 58.88 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.584 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -121.94 39.41 2.33 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.312 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.465 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -49.26 -40.65 35.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.866 0.365 . . . . 0.0 111.469 -179.767 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 1.9 m170 -55.43 -33.9 63.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.58 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.608 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.3 m -67.45 -74.41 0.12 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.511 ' CG1' ' CD2' ' A' ' 71' ' ' LEU . 39.7 t -51.12 -40.73 22.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.083 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.483 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 56.6 t-80 -49.84 -40.88 43.75 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -76.54 -28.35 56.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.635 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.608 HG22 ' O ' ' A' ' 81' ' ' THR . 0.2 OUTLIER -85.3 -33.13 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.962 -179.589 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.506 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.2 OUTLIER -74.38 -46.53 39.82 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.851 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.35 -30.28 66.61 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.403 ' O ' ' CD1' ' A' ' 92' ' ' ILE . 2.5 m-80 -82.75 -68.15 0.73 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.335 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.485 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -50.53 -45.76 26.47 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.473 -179.761 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.2 mmmm -62.53 -30.21 71.12 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.734 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -90.75 -2.32 57.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.278 178.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.44 ' HB ' ' O ' ' A' ' 89' ' ' ILE . 1.1 mp -78.68 -35.63 18.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.634 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -65.37 -30.81 71.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.506 179.177 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.634 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.1 OUTLIER -59.88 -57.09 14.38 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.318 -179.207 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -69.81 -9.96 56.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.387 178.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.456 HD21 ' HG ' ' A' ' 9' ' ' LEU . 35.5 mt -89.43 -54.24 4.18 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.456 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -62.97 -13.15 31.36 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 177.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.43 ' O ' ' CB ' ' A' ' 102' ' ' ARG . 0.1 OUTLIER -80.75 -1.3 42.22 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.836 179.383 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.522 HD11 ' HG ' ' A' ' 5' ' ' LEU . 4.1 mt -96.1 -67.2 0.86 Allowed 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.127 0.489 . . . . 0.0 110.597 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 41.3 t -59.78 -27.45 38.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.946 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -86.91 -33.08 19.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.107 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.43 ' CB ' ' O ' ' A' ' 98' ' ' GLU . 38.2 ttp180 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.952 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 ttt . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.843 0.354 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.415 ' CE1' ' HG3' ' A' ' 102' ' ' ARG . 66.6 m-85 -91.6 112.54 24.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.885 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.471 ' HA2' ' HG3' ' A' ' 48' ' ' MET . . . -175.13 -36.65 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.609 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.7 tptt -55.87 -19.55 12.25 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.54 0.17 . . . . 0.0 111.241 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.439 ' CD2' HD11 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -49.65 -23.51 1.76 Allowed 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.35 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -58.42 -42.74 87.9 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.742 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -48.81 -30.6 5.91 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.273 0.558 . . . . 0.0 109.752 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -83.64 -35.58 24.49 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.933 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.406 ' O ' HD21 ' A' ' 12' ' ' LEU . 7.9 mt -62.23 -40.95 97.87 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.82 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -49.0 -44.26 40.99 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.683 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -49.71 -45.74 49.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.101 -179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.464 ' O ' ' CD2' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -56.54 -61.64 2.28 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.717 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.464 ' HA ' HD21 ' A' ' 16' ' ' LEU . 4.0 tm0? -51.53 -39.3 57.44 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.481 -179.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -75.53 -28.77 59.2 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.509 ' CG2' ' HA ' ' A' ' 85' ' ' ILE . 0.3 OUTLIER -67.69 -27.42 38.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.976 179.031 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.464 ' CD2' ' O ' ' A' ' 12' ' ' LEU . 2.9 mm? -64.8 -29.7 70.68 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.722 178.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.512 ' HA ' ' HD1' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -47.51 -39.95 17.42 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.21 0.529 . . . . 0.0 110.075 179.277 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -73.82 -45.49 51.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.072 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.589 ' HG ' HD12 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -46.9 -42.95 18.39 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.618 -179.836 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.512 ' HD1' ' HA ' ' A' ' 17' ' ' LYS . 40.5 m80 -48.81 -40.82 30.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.869 0.366 . . . . 0.0 111.734 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.485 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 3.9 mmpt? -89.2 5.78 43.17 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.49 ' HB2' ' CG2' ' A' ' 81' ' ' THR . 3.8 m120 -142.03 5.21 1.7 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.468 -0.493 . . . . 0.0 112.274 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.668 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -81.07 -51.91 7.97 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.738 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.5 ' HB3' ' CZ2' ' A' ' 23' ' ' TRP . 8.7 t-160 179.56 58.67 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.939 0.4 . . . . 0.0 110.876 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 116.72 -104.05 1.18 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.061 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -128.81 -146.24 6.14 Favored Glycine 0 N--CA 1.443 -0.9 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.961 179.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.476 ' O ' ' N ' ' A' ' 31' ' ' HIS . 0.1 OUTLIER -94.18 -13.28 26.84 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -49.14 -62.66 1.41 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.8 m-80 -77.32 -27.83 53.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.695 0.283 . . . . 0.0 110.728 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.668 ' HB2' ' CD1' ' A' ' 23' ' ' TRP . 1.3 tm? -68.37 -31.18 70.37 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.476 ' N ' ' O ' ' A' ' 27' ' ' LYS . 3.8 t-80 -45.25 -58.69 3.1 Favored 'General case' 0 CA--C 1.523 -0.091 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.803 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.4 -21.99 52.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.015 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.515 HG13 HD11 ' A' ' 30' ' ' LEU . 1.5 t -87.09 -64.93 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.691 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.492 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 1.1 t70 -59.46 -21.67 60.41 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.234 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.404 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 2.7 m-20 -59.8 -39.84 86.35 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 177.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.44 ' O ' ' CG2' ' A' ' 40' ' ' VAL . 1.3 m-70 -63.51 -52.57 60.64 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 177.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.484 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -54.59 -67.31 0.28 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.684 178.328 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -47.41 -43.49 23.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.182 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -66.86 -25.2 66.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.546 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.564 ' O ' HG13 ' A' ' 44' ' ' ILE . 81.3 t -75.21 -39.86 43.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.418 HG22 ' N ' ' A' ' 42' ' ' GLU . 6.9 tp -43.23 -35.45 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.184 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.418 ' N ' HG22 ' A' ' 41' ' ' ILE . 5.8 pt-20 -75.86 -40.82 53.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.192 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.508 ' O ' ' HB3' ' A' ' 47' ' ' PHE . 4.2 p30 -62.14 -30.79 71.28 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 40' ' ' VAL . 2.3 mt -86.84 -40.55 14.14 Favored 'Isoleucine or valine' 0 C--N 1.337 0.051 0 CA-C-O 121.043 0.449 . . . . 0.0 109.972 178.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.402 ' NE2' HG13 ' A' ' 41' ' ' ILE . 18.6 m170 -59.39 -40.97 88.26 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.423 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -82.59 -10.02 59.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.803 178.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.519 ' HB3' ' HA ' ' A' ' 44' ' ' ILE . 0.0 OUTLIER -87.8 -36.7 17.13 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.161 -179.847 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.471 ' HG3' ' HA2' ' A' ' 3' ' ' GLY . 10.2 ptt? -49.06 -28.8 4.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.296 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -79.07 -21.48 46.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.469 -179.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 117.29 -6.22 17.05 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.558 -0.829 . . . . 0.0 113.04 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.43 -28.62 6.66 Favored Glycine 0 C--N 1.334 0.422 0 C-N-CA 120.571 -0.823 . . . . 0.0 112.078 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -156.09 27.67 0.57 Allowed Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.514 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 25.8 p -74.0 148.37 42.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.025 0.44 . . . . 0.0 111.381 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 74.42 52.96 7.02 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 115.703 -0.681 . . . . 0.0 112.762 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 162.74 -35.03 0.33 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.386 -0.912 . . . . 0.0 113.274 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.455 ' HE2' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -88.35 -38.96 14.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.95 0.375 . . . . 0.0 111.759 -179.478 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.564 ' O ' ' HB3' ' A' ' 61' ' ' MET . 47.1 tp -60.51 -10.91 5.65 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.484 ' O ' ' HG3' ' A' ' 61' ' ' MET . 3.8 pt20 -85.74 -49.33 8.03 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.837 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.41 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 3.7 mt-10 -87.58 -28.94 21.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.95 0.405 . . . . 0.0 110.328 179.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.402 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -77.18 -33.92 56.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.91 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.564 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -53.64 -41.43 66.73 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.106 0.479 . . . . 0.0 110.389 179.748 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 19.1 mmtt -57.75 -24.21 55.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.939 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -42.91 76.88 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.424 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.484 ' CD2' ' O ' ' A' ' 61' ' ' MET . 1.7 p90 -69.92 -29.66 66.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.923 0.392 . . . . 0.0 110.421 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -82.41 -30.58 30.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.41 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.59 -41.25 73.1 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.605 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.487 ' CG1' ' CG1' ' A' ' 33' ' ' VAL . 14.6 t -56.15 -50.09 72.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.027 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.513 ' HG ' HD23 ' A' ' 71' ' ' LEU . 0.4 OUTLIER -63.13 -16.38 59.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.618 179.13 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -65.62 -61.19 2.23 Favored 'General case' 0 C--O 1.231 0.097 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.46 ' CG ' ' CZ3' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -51.06 -36.59 40.74 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.906 0.86 . . . . 0.0 109.401 178.175 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.589 HD12 ' HG ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -70.68 -69.11 0.38 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 113.745 -1.57 . . . . 0.0 112.336 -178.884 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.404 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 2.6 m-20 -50.25 -26.26 4.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.56 -179.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -88.69 9.8 23.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.506 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.625 ' O ' ' N ' ' A' ' 76' ' ' GLN . 79.0 m-70 -153.82 28.72 0.47 Allowed 'General case' 0 CA--C 1.52 -0.18 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.571 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.3 OUTLIER -49.38 85.3 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.016 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.625 ' N ' ' O ' ' A' ' 74' ' ' HIS . 16.9 mm-40 -82.05 -37.74 26.0 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.052 -177.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -83.75 -58.07 2.32 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.223 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 174.53 121.82 0.65 Allowed Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.231 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.571 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 1.3 mtmt -42.75 -30.41 0.38 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -43.18 -35.02 1.25 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.76 0.314 . . . . 0.0 111.417 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.512 ' O ' HG23 ' A' ' 85' ' ' ILE . 1.4 m -69.93 -74.23 0.14 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.554 ' O ' ' N ' ' A' ' 86' ' ' GLU . 27.3 t -48.58 -38.44 9.45 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.403 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.098 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.484 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 1.3 t-80 -50.77 -41.29 56.65 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -76.2 -28.14 57.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.624 178.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.513 HG12 ' HA ' ' A' ' 82' ' ' VAL . 0.2 OUTLIER -85.67 -33.6 7.79 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.14 -179.748 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.554 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -75.3 -45.42 39.9 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.801 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 91' ' ' GLU . 1.5 mp0 -59.62 -29.66 68.15 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 178.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.402 ' O ' ' CD1' ' A' ' 92' ' ' ILE . 1.9 m-80 -82.96 -63.58 1.34 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.438 179.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.484 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -55.03 -43.77 71.12 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.22 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.468 -179.73 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -63.37 -29.32 70.65 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.133 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 87' ' ' GLN . 0.4 OUTLIER -90.39 -6.81 54.53 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.102 178.522 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.529 ' O ' ' HG ' ' A' ' 96' ' ' LEU . 1.1 mp -72.9 -42.25 60.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.638 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -58.47 -27.65 64.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.365 178.763 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.638 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.0 OUTLIER -62.47 -63.88 1.09 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.169 -179.222 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 11.8 m80 -64.21 -10.5 23.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.144 178.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 31.3 mt -88.52 -55.57 3.67 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.086 0.47 . . . . 0.0 110.061 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.428 ' N ' HD21 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -72.9 -7.88 53.0 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.932 178.7 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -90.96 -25.26 19.84 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.758 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.439 HD11 ' CD2' ' A' ' 5' ' ' LEU . 15.9 tp -70.17 -52.77 20.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.157 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 33.4 t -69.64 -27.99 35.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.423 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -77.51 -38.58 48.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.761 0.315 . . . . 0.0 110.975 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.415 ' HG3' ' CE1' ' A' ' 2' ' ' TYR . 12.6 ptp180 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.953 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpp? . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.912 0.387 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -131.49 140.42 49.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.879 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 130.35 -40.71 1.63 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.181 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.77 -16.67 61.77 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 120.567 0.222 . . . . 0.0 110.589 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.39 -23.92 4.31 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 177.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.481 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 23.4 t-20 -63.64 -46.51 85.36 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.612 178.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -48.62 -35.12 12.96 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -88.07 -29.13 20.87 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.144 178.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 0.4 OUTLIER -70.06 -33.03 71.42 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.056 0.455 . . . . 0.0 110.292 179.829 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -54.54 -40.68 68.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.235 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.443 ' HA ' ' HG2' ' A' ' 14' ' ' GLU . 0.4 OUTLIER -48.32 -43.77 33.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.931 0.396 . . . . 0.0 110.848 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.493 ' O ' HG13 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -57.79 -60.53 3.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.768 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.429 ' HA ' HD23 ' A' ' 16' ' ' LEU . 4.8 tp60 -51.47 -41.36 60.84 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.555 -179.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.443 ' HG2' ' HA ' ' A' ' 11' ' ' ASP . 10.8 pt-20 -74.21 -22.02 59.55 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.846 0.355 . . . . 0.0 110.203 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.493 HG13 ' O ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -74.21 -27.14 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.254 179.249 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.471 ' HA ' ' HB3' ' A' ' 19' ' ' LEU . 3.1 mm? -65.54 -34.62 78.68 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.356 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.82 -42.99 8.35 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 121.104 0.478 . . . . 0.0 110.247 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -68.35 -42.86 78.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.477 0.656 . . . . 0.0 109.263 178.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.603 ' HG ' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -53.66 -37.05 62.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.814 179.683 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.548 ' HA ' ' HG ' ' A' ' 30' ' ' LEU . 49.3 m-70 -54.04 -34.48 60.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.386 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.519 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.4 mmpt? -94.29 3.39 55.28 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -138.91 -1.43 1.79 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.562 ' CB ' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -72.88 -56.02 5.79 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.21 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.561 ' HB3' ' CH2' ' A' ' 23' ' ' TRP . 8.2 t-160 179.04 47.18 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.843 178.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 51.26 172.57 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.106 -0.569 . . . . 0.0 113.205 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.6 78.92 0.13 Allowed Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 121.012 -0.614 . . . . 0.0 112.283 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -27.05 5.52 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.95 -30.65 66.14 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.85 178.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -78.81 -40.51 32.77 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.548 ' HG ' ' HA ' ' A' ' 20' ' ' HIS . 1.1 tm? -65.97 -36.38 83.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.383 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.422 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 0.3 OUTLIER -46.48 -43.43 16.71 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.239 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.5 -21.3 55.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.467 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.524 HG13 ' O ' ' A' ' 30' ' ' LEU . 0.6 OUTLIER -88.3 -46.36 15.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.11 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.458 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 2.6 t0 -74.58 -34.33 62.86 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 179.374 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.422 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 2.3 t30 -53.28 -29.17 31.81 Favored 'General case' 0 C--N 1.334 -0.077 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -57.05 -52.95 63.22 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.806 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.47 HD23 ' HG ' ' A' ' 16' ' ' LEU . 0.2 OUTLIER -77.1 -32.71 56.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.826 178.825 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.413 ' N ' ' HG ' ' A' ' 37' ' ' LEU . 2.2 tm0? -54.96 -37.47 66.53 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -83.42 -18.3 39.18 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.952 178.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.578 ' O ' HG13 ' A' ' 44' ' ' ILE . 55.3 t -75.97 -40.81 38.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.125 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 2.3 tp -45.53 -35.9 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.278 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.56 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 0.4 OUTLIER -75.56 -28.03 58.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.561 179.546 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.574 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 1.3 m-20 -79.38 -26.32 42.01 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.737 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.578 HG13 ' O ' ' A' ' 40' ' ' VAL . 2.8 mt -86.17 -57.69 4.08 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.856 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.56 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -58.76 -27.31 64.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.04 -179.948 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.503 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 27.6 t0 -86.67 -26.36 24.35 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.574 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.9 m-85 -83.74 -52.49 6.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.273 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.433 ' CE ' ' N ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -51.97 -21.64 3.23 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.399 -179.411 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.08 16.09 10.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.348 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 102.41 31.99 5.04 Favored Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.89 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -111.22 24.98 14.71 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.614 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.72 25.74 9.63 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.643 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -20.02 55.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.636 0.255 . . . . 0.0 111.235 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -77.02 70.86 2.28 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.982 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.448 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . 133.64 -7.33 4.91 Favored Glycine 0 CA--C 1.518 0.223 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.953 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.46 ' HE3' ' CD2' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -88.73 -37.48 15.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.669 0.271 . . . . 0.0 111.213 -179.89 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.482 ' O ' ' CB ' ' A' ' 61' ' ' MET . 0.0 OUTLIER -63.59 -11.98 29.29 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.248 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 1.7 pp0? -86.03 -49.92 7.44 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.551 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -86.92 -30.46 21.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.753 0.311 . . . . 0.0 110.576 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.41 ' CG ' ' HD3' ' A' ' 56' ' ' LYS . 0.6 OUTLIER -77.88 -31.06 51.13 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.753 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.482 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -55.17 -33.82 63.3 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.896 0.379 . . . . 0.0 110.489 179.771 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.3 tttt -67.39 -26.15 66.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.092 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -70.51 -37.25 74.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.692 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.466 ' CZ ' HG22 ' A' ' 92' ' ' ILE . 0.3 OUTLIER -85.09 -27.8 26.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.939 0.4 . . . . 0.0 110.438 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -82.45 -29.9 30.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.231 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 69' ' ' ASP . 1.1 tm0? -62.7 -36.09 81.83 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.597 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.51 HG12 HG12 ' A' ' 33' ' ' VAL . 72.1 t -52.18 -39.97 28.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.7 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.544 ' CD2' HG13 ' A' ' 85' ' ' ILE . 1.0 OUTLIER -73.67 -5.3 39.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.004 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 66' ' ' GLN . 2.2 m-20 -78.08 -56.38 4.52 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.445 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 4.8 tp10 -52.43 -32.5 39.66 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 122.029 0.919 . . . . 0.0 108.788 177.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.603 HD11 ' HG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -79.13 -64.98 1.06 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.883 -179.106 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.409 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 65.2 t30 -50.46 -24.73 3.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.748 -179.277 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -88.74 3.89 49.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.817 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.497 ' O ' ' N ' ' A' ' 76' ' ' GLN . 91.3 m-70 -147.19 26.97 1.06 Allowed 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.523 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -49.5 91.95 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.027 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 74' ' ' HIS . 13.2 tt0 -64.54 68.23 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.594 -178.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 56.33 29.08 56.19 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.666 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -138.96 48.92 0.84 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.385 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.523 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -55.42 -36.09 66.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.541 0.21 . . . . 0.0 111.496 -179.764 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -45.26 -32.87 2.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.636 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.533 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.2 m -69.69 -74.64 0.13 Allowed 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.524 ' HA ' HG12 ' A' ' 85' ' ' ILE . 38.3 t -48.83 -38.81 10.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.98 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.482 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -50.26 -41.57 50.63 Favored 'General case' 0 CA--C 1.522 -0.12 0 CA-C-O 121.145 0.498 . . . . 0.0 109.713 179.405 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -76.16 -27.21 56.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.564 178.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.544 HG13 ' CD2' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.52 -35.76 10.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.074 -179.846 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.482 ' CG ' ' HA ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -71.24 -44.69 64.83 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.477 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -61.53 -29.05 69.75 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.417 ' O ' ' CD1' ' A' ' 92' ' ' ILE . 2.1 m-80 -83.01 -64.75 1.11 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.222 178.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.472 ' HA ' ' HB ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -54.12 -50.85 52.01 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.41 -179.745 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.407 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 7.2 mmmt -59.78 -29.5 68.24 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.007 -0.677 . . . . 0.0 109.725 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -90.83 -3.23 57.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.361 178.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.472 ' HB ' ' HA ' ' A' ' 89' ' ' ILE . 1.1 mp -78.69 -40.09 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.633 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -60.01 -26.41 66.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.298 178.886 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.633 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 4.0 t60 -62.35 -65.44 0.69 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.157 -179.25 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -61.7 -10.71 9.24 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.207 178.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.466 ' HB3' HD13 ' A' ' 57' ' ' LEU . 44.2 mt -89.34 -63.5 1.28 Allowed 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.943 0.401 . . . . 0.0 110.566 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -67.87 -11.77 59.32 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.324 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.421 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 0.9 OUTLIER -89.7 -13.12 37.58 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.879 179.565 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 10.0 tp -82.01 -56.45 3.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.016 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.9 t -66.67 -43.77 90.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.499 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -59.86 -28.33 67.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.015 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 32.7 ttt-85 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.859 179.938 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtm . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.838 0.352 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.471 ' CD1' HD12 ' A' ' 99' ' ' LEU . 25.8 m-85 -114.77 111.92 22.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.873 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -133.46 8.88 5.0 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.9 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -87.96 -19.41 27.28 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.744 0.272 . . . . 0.0 110.74 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.456 ' N ' ' HE2' ' A' ' 48' ' ' MET . 0.1 OUTLIER -54.62 -19.3 5.76 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.728 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -61.15 -44.9 96.59 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.961 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -49.75 -28.08 5.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.045 0.45 . . . . 0.0 110.139 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -87.64 -28.24 21.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.409 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.472 ' O ' HD12 ' A' ' 12' ' ' LEU . 8.7 mt -73.18 -38.6 66.1 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.858 0.361 . . . . 0.0 110.774 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -42.83 -32.85 0.67 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.446 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.0 -52.2 13.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.519 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.547 ' CB ' HG12 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -50.98 -43.2 60.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.301 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.447 ' HA ' HD23 ' A' ' 16' ' ' LEU . 2.0 tt0 -73.51 -38.08 65.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.626 0.251 . . . . 0.0 111.5 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -73.89 -27.58 61.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.08 0.467 . . . . 0.0 110.132 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.577 HG12 ' HB ' ' A' ' 85' ' ' ILE . 0.9 OUTLIER -64.83 -24.34 35.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.333 179.163 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.523 ' CD2' ' O ' ' A' ' 12' ' ' LEU . 1.1 mm? -66.49 -37.94 86.17 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.237 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.48 -33.17 1.62 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 121.172 0.511 . . . . 0.0 110.288 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -76.79 -45.84 27.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.903 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.595 ' HG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -47.85 -42.61 26.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.267 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.515 ' CE1' ' CD1' ' A' ' 30' ' ' LEU . 56.3 m-70 -48.43 -42.46 32.32 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.266 -0.424 . . . . 0.0 112.035 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.434 ' HE3' ' C ' ' A' ' 20' ' ' HIS . 0.0 OUTLIER -86.24 5.01 36.33 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -177.248 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.484 ' HB2' ' CG2' ' A' ' 81' ' ' THR . 9.0 m-80 -146.01 12.63 1.26 Allowed 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.383 -0.527 . . . . 0.0 112.135 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.692 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -84.78 -33.59 22.97 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.893 179.87 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.477 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 3.1 t-160 -178.32 -51.18 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.646 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.81 138.73 2.96 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.755 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.44 104.37 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.394 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.4 tttt -53.01 -23.79 8.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.697 0.284 . . . . 0.0 110.775 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -50.91 -31.94 19.15 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.804 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -85.99 -46.91 10.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.496 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.692 ' HB2' ' CD1' ' A' ' 23' ' ' TRP . 2.0 tm? -60.31 -29.96 69.19 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.404 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 17.0 t-160 -45.69 -56.44 5.25 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.694 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.12 -24.1 62.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.967 0.413 . . . . 0.0 110.779 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.503 ' CG1' HD22 ' A' ' 30' ' ' LEU . 1.3 t -84.66 -66.1 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.522 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.459 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -57.87 -23.25 52.2 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.298 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.404 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 16.3 m-20 -56.97 -39.44 74.61 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 177.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.54 -45.63 78.79 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.72 -1.127 . . . . 0.0 108.028 177.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.488 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -56.7 -67.13 0.34 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.794 178.612 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -44.58 -41.79 6.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.056 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -62.21 -29.8 70.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.299 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.567 ' O ' HG12 ' A' ' 44' ' ' ILE . 97.6 t -62.54 -54.82 28.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.27 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.472 ' CG2' ' CE1' ' A' ' 45' ' ' HIS . 17.3 mm -42.5 -46.13 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.938 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.429 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 1.1 pt-20 -68.02 -29.86 68.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.884 0.373 . . . . 0.0 110.405 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.557 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.9 OUTLIER -81.39 -25.2 36.45 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.921 -0.582 . . . . 0.0 109.96 178.848 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.567 HG12 ' O ' ' A' ' 40' ' ' VAL . 9.1 mm -87.17 -38.19 11.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.67 179.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.472 ' CE1' ' CG2' ' A' ' 41' ' ' ILE . 11.6 m170 -78.03 -42.3 32.93 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.633 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -72.04 -27.6 62.81 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.82 0.343 . . . . 0.0 110.47 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.557 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.8 m-85 -88.48 -45.61 9.8 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.456 ' HE2' ' N ' ' A' ' 5' ' ' LEU . 8.1 ptm -46.7 -38.16 9.45 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 120.813 0.34 . . . . 0.0 111.443 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.47 -21.33 66.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.299 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 133.05 24.93 0.69 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.945 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -102.29 35.25 5.09 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.137 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.11 32.57 4.29 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.221 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 88.8 p -59.61 -22.48 61.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.687 0.28 . . . . 0.0 111.107 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -91.91 75.1 1.44 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.52 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 145.26 -17.14 1.9 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.619 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.46 ' O ' ' CB ' ' A' ' 60' ' ' MET . 2.9 pptp? -88.21 -39.97 14.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.783 0.325 . . . . 0.0 110.915 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.528 ' O ' ' CB ' ' A' ' 61' ' ' MET . 7.0 tp -65.85 -9.38 28.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.943 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -86.15 -50.08 7.27 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.311 -0.556 . . . . 0.0 110.696 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -87.39 -30.68 20.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.474 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.46 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 17.5 tpp -78.14 -33.11 50.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.163 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.528 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 2.4 tmm? -56.12 -41.97 76.12 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 120.189 -0.604 . . . . 0.0 109.843 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.04 -26.69 65.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.918 178.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.27 -34.4 78.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.049 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.507 ' CZ ' HG23 ' A' ' 92' ' ' ILE . 0.9 OUTLIER -87.38 -26.46 23.31 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.851 0.358 . . . . 0.0 110.606 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -82.64 -32.41 28.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.826 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -57.41 -39.3 75.87 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.202 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.495 ' CG1' ' CG1' ' A' ' 33' ' ' VAL . 13.0 t -50.19 -44.67 23.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.005 0.431 . . . . 0.0 110.584 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.503 ' CD2' HG13 ' A' ' 85' ' ' ILE . 0.7 OUTLIER -66.25 -13.81 60.96 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.059 179.534 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -67.84 -58.61 4.3 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.474 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 1.9 tp10 -52.81 -37.51 60.04 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 122.0 0.905 . . . . 0.0 109.486 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.595 HD13 ' HG ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -72.11 -69.4 0.4 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.652 -1.613 . . . . 0.0 112.565 -178.76 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.12 -26.69 4.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.687 -179.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -90.97 12.4 19.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.244 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.6 ' O ' ' N ' ' A' ' 76' ' ' GLN . 79.4 m-70 -156.33 30.08 0.34 Allowed 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.512 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -50.7 85.25 0.0 OUTLIER 'General case' 0 C--O 1.232 0.157 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.6 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -81.49 -37.54 27.76 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.837 -177.637 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -82.21 -65.85 1.61 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.783 -0.722 . . . . 0.0 113.183 -179.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -179.12 120.12 0.68 Allowed Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.171 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.512 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -40.08 -30.71 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.672 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -44.75 -34.46 2.28 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.848 0.356 . . . . 0.0 111.263 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.484 ' CG2' ' HB2' ' A' ' 22' ' ' ASN . 1.8 m -68.67 -73.26 0.15 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.543 ' HA ' HG12 ' A' ' 85' ' ' ILE . 24.3 t -50.24 -38.8 15.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.169 179.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.456 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -48.83 -40.83 30.84 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.401 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -76.2 -29.46 57.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.62 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.577 ' HB ' HG12 ' A' ' 15' ' ' VAL . 0.2 OUTLIER -85.54 -35.4 9.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.36 -179.529 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.525 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -73.79 -39.62 64.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.697 0.284 . . . . 0.0 110.248 179.316 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.418 ' O ' ' CB ' ' A' ' 91' ' ' GLU . 2.3 mp0 -67.07 -31.05 71.28 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -83.02 -44.24 15.44 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.594 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.569 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.1 OUTLIER -74.1 -54.87 13.88 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.564 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.275 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.569 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 5.9 mmmt -58.56 -28.98 66.02 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.224 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.418 ' CB ' ' O ' ' A' ' 87' ' ' GLN . 2.1 tt0 -90.92 -2.62 57.71 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.547 HG12 ' CB ' ' A' ' 12' ' ' LEU . 1.2 tp -78.82 -49.06 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.321 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.649 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.2 OUTLIER -48.29 -26.34 1.96 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.49 179.284 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.649 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 20.6 t-80 -65.1 -66.74 0.5 Allowed 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.816 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -60.79 -12.79 11.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.982 -0.553 . . . . 0.0 109.894 178.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.49 ' CD1' HG22 ' A' ' 92' ' ' ILE . 22.1 mt -86.04 -64.96 1.07 Allowed 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 120.952 0.406 . . . . 0.0 110.133 179.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.31 -16.7 55.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.789 178.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -86.96 2.67 48.66 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.668 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.471 HD12 ' CD1' ' A' ' 2' ' ' TYR . 16.5 tp -100.81 -63.02 1.17 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.969 0.414 . . . . 0.0 110.796 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 39.8 t -61.86 -28.73 44.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.391 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 38.2 m170 -96.59 33.63 1.8 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.021 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.874 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.0 mtp . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.787 0.327 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.434 ' CD1' HD11 ' A' ' 99' ' ' LEU . 58.9 m-85 -102.92 86.07 2.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.787 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -130.42 9.14 5.9 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.777 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 26.6 tptp -95.57 -21.17 18.43 Favored 'General case' 0 CA--C 1.507 -0.674 0 CA-C-O 120.599 0.237 . . . . 0.0 110.637 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.418 ' CD2' HD13 ' A' ' 99' ' ' LEU . 0.2 OUTLIER -52.04 -23.12 4.77 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.261 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.469 ' HB3' ' CE ' ' A' ' 48' ' ' MET . 26.4 p-10 -60.02 -40.18 88.42 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.569 178.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -49.84 -29.83 8.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.123 0.487 . . . . 0.0 110.027 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.419 ' HG ' ' CD2' ' A' ' 95' ' ' HIS . 2.4 tm? -85.06 -31.25 23.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.247 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.419 ' HG ' HD22 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -68.3 -33.72 74.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.459 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -48.58 -45.51 38.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.324 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -40.67 78.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.776 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.53 ' HG ' ' N ' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -59.51 -63.4 1.32 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.747 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.53 ' N ' ' HG ' ' A' ' 12' ' ' LEU . 13.0 tt0 -48.61 -41.17 30.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.617 -179.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -71.38 -30.12 65.76 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.101 0.477 . . . . 0.0 109.867 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.637 ' CG2' ' HA ' ' A' ' 85' ' ' ILE . 0.4 OUTLIER -66.11 -23.77 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.225 178.9 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.507 ' HA ' HD13 ' A' ' 85' ' ' ILE . 3.8 mm? -67.7 -33.92 75.86 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 177.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.403 ' HA ' ' CE ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -42.05 -42.16 2.8 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 121.189 0.518 . . . . 0.0 109.971 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.511 ' C ' HG22 ' A' ' 81' ' ' THR . 6.4 m-20 -64.37 -49.11 72.94 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.258 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.574 ' HB2' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -48.15 -57.16 6.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.719 -179.999 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.509 ' HA ' ' HG ' ' A' ' 30' ' ' LEU . 40.8 m-70 -45.25 -27.62 0.67 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.507 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.4 mmpt? -94.29 -20.09 20.1 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -177.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.415 ' O ' HD12 ' A' ' 75' ' ' LEU . 25.3 m120 -122.99 -6.25 8.43 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.59 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -59.66 -33.28 71.34 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.894 -179.793 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.503 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 78.7 t60 -175.97 -52.65 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.566 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.5 129.35 1.73 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.844 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 71.55 115.09 0.05 OUTLIER Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.354 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -58.66 -18.61 32.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.569 0.224 . . . . 0.0 110.862 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -51.64 -38.1 53.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.627 0.251 . . . . 0.0 110.927 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -83.79 -44.63 14.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.466 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.59 ' HB2' ' CD1' ' A' ' 23' ' ' TRP . 1.4 tm? -62.1 -27.3 68.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.137 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.404 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.2 OUTLIER -48.62 -36.09 15.05 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.627 179.876 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.11 -25.07 55.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.975 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.494 ' CG1' HD23 ' A' ' 30' ' ' LEU . 1.9 t -87.45 -56.67 5.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.758 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.453 ' CB ' ' CE1' ' A' ' 20' ' ' HIS . 0.5 OUTLIER -59.02 -25.39 63.63 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.475 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.404 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 1.0 OUTLIER -58.73 -40.41 83.69 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 178.145 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.4 ' CD2' ' OE1' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -63.48 -49.78 72.27 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 177.777 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.488 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -55.47 -67.92 0.24 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.55 178.379 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.3 tm0? -45.68 -42.8 12.03 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.016 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -61.89 -30.69 71.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.326 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.538 ' O ' HG12 ' A' ' 44' ' ' ILE . 61.8 t -64.39 -52.69 52.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.357 179.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.439 HG22 ' CE1' ' A' ' 45' ' ' HIS . 1.5 mp -42.77 -41.15 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.722 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.425 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 0.1 OUTLIER -72.77 -28.3 62.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.925 0.393 . . . . 0.0 110.429 179.775 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.524 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 1.1 m-20 -84.03 -28.87 27.35 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.899 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.538 HG12 ' O ' ' A' ' 40' ' ' VAL . 18.2 mm -86.67 -39.01 12.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.972 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.439 ' CE1' HG22 ' A' ' 41' ' ' ILE . 11.6 m170 -77.94 -36.55 49.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.643 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.409 ' CB ' ' O ' ' A' ' 42' ' ' GLU . 9.8 t70 -76.62 -27.67 55.81 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.67 0.271 . . . . 0.0 110.533 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.524 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 4.1 m-85 -88.35 -43.4 11.54 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.908 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.469 ' CE ' ' HB3' ' A' ' 6' ' ' ASN . 25.5 ptt? -46.6 -29.57 1.88 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.807 0.337 . . . . 0.0 111.457 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -68.61 -28.11 66.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.105 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 141.21 -12.5 2.8 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.875 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -55.13 -22.63 29.61 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.716 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 155.21 55.0 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.281 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.2 t -76.17 -20.16 57.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.601 0.239 . . . . 0.0 111.39 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.8 74.03 2.11 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.542 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 145.6 -17.52 1.84 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.637 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.452 ' O ' ' CB ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.18 -43.08 11.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.673 0.273 . . . . 0.0 111.086 179.893 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.51 ' O ' ' CB ' ' A' ' 61' ' ' MET . 44.9 tp -64.34 -10.29 23.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.739 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -85.97 -49.75 7.6 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.853 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -87.14 -30.13 21.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.343 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.452 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 3.7 tpt -78.11 -31.39 49.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.861 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.51 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -56.16 -39.01 71.65 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.315 179.714 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.69 -11.57 60.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.144 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.4 ' OE1' ' CD2' ' A' ' 36' ' ' HIS . 3.3 tp10 -84.82 -26.25 27.57 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.46 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.461 ' CD1' ' C ' ' A' ' 64' ' ' PHE . 1.4 p90 -87.19 -28.81 22.19 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.749 0.309 . . . . 0.0 110.92 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.38 -30.28 30.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.701 179.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -30.7 67.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.825 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.488 ' CG2' ' HB2' ' A' ' 37' ' ' LEU . 24.3 t -57.43 -59.87 2.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.566 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.464 HD13 HD11 ' A' ' 85' ' ' ILE . 1.7 mp -61.04 -13.7 18.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.369 178.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -66.82 -52.28 45.63 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.47 ' CG ' ' CZ3' ' A' ' 23' ' ' TRP . 0.2 OUTLIER -58.62 -33.63 70.25 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.76 0.79 . . . . 0.0 108.941 177.69 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.574 HD11 ' HB2' ' A' ' 19' ' ' LEU . 0.8 OUTLIER -63.76 -65.91 0.62 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.265 -1.334 . . . . 0.0 111.851 -179.516 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 15.1 t30 -49.77 -23.91 2.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.708 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -85.24 -3.51 58.84 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 33.4 m-70 -150.92 36.49 0.62 Allowed 'General case' 0 CA--C 1.52 -0.188 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.5 ' CD2' ' CG2' ' A' ' 82' ' ' VAL . 0.5 OUTLIER -67.46 85.35 0.17 Allowed 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.343 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -68.03 65.75 0.1 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.97 -178.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.94 54.41 21.73 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.463 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -154.15 28.67 0.72 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.577 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.1 mmpt? -43.11 -27.35 0.21 Allowed 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 22.8 p80 -57.5 -41.22 80.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.162 0.506 . . . . 0.0 110.514 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.511 HG22 ' C ' ' A' ' 18' ' ' ASN . 1.4 m -58.65 -52.35 66.06 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.156 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.725 ' HA ' ' CG2' ' A' ' 85' ' ' ILE . 0.2 OUTLIER -57.95 -60.05 2.67 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.529 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.55 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 60.8 t-80 -42.88 -40.02 2.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.877 0.37 . . . . 0.0 110.485 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -76.28 -49.05 18.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.177 179.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.725 ' CG2' ' HA ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -75.34 -16.74 15.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.723 -179.231 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.618 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -93.08 -44.1 8.55 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 179.196 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.469 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 1.1 mp0 -62.69 -23.94 67.39 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 177.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.454 ' CB ' HG22 ' A' ' 15' ' ' VAL . 1.3 m-80 -82.73 -59.49 2.49 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 114.491 -1.231 . . . . 0.0 110.07 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.595 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -65.07 -49.68 78.24 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.35 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.453 -179.743 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.421 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 1.3 tptp -58.47 -27.33 64.3 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.494 -0.482 . . . . 0.0 109.941 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -90.7 -4.69 56.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.25 178.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.503 ' O ' ' HG ' ' A' ' 96' ' ' LEU . 1.0 OUTLIER -78.65 -48.02 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 179.525 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.627 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.2 OUTLIER -48.06 -28.21 2.72 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.456 179.16 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.627 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 34.0 t-80 -62.6 -63.51 1.2 Allowed 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.986 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.419 ' CD2' ' HG ' ' A' ' 8' ' ' LEU . 22.8 m-70 -65.8 -9.17 26.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.182 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 19.3 mt -89.19 -59.87 2.1 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 120.982 0.42 . . . . 0.0 110.149 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.433 ' N ' HD21 ' A' ' 57' ' ' LEU . 87.2 mt-10 -69.0 -12.47 61.71 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.851 178.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -85.97 -22.51 27.32 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.625 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.434 HD11 ' CD1' ' A' ' 2' ' ' TYR . 27.8 tp -75.29 -60.47 2.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.896 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.6 t -59.88 -41.09 84.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.389 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.4 -30.56 70.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.919 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.824 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 ttm . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.867 0.365 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.435 ' CG ' HD13 ' A' ' 99' ' ' LEU . 5.0 m-85 -147.72 86.33 1.59 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -116.37 -14.28 7.71 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.725 -0.75 . . . . 0.0 113.024 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.82 -19.78 61.26 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 116.758 0.279 . . . . 0.0 111.193 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.93 -23.34 4.85 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.453 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 16.5 t-20 -65.53 -36.26 83.29 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.766 179.001 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -48.5 -35.79 13.85 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -88.25 -29.0 20.75 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.093 178.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.463 ' O ' HD21 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -71.83 -27.01 62.62 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 120.825 0.345 . . . . 0.0 110.619 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -58.55 -46.23 87.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.269 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -46.59 -39.03 10.42 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.985 0.422 . . . . 0.0 111.201 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.51 ' O ' HG11 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -58.53 -61.47 2.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.663 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.454 ' HA ' HD22 ' A' ' 16' ' ' LEU . 1.8 tt0 -52.19 -34.9 47.45 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.791 -179.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.33 -29.7 53.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.889 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.51 HG11 ' O ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -65.05 -34.52 71.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.834 179.104 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.507 ' N ' HG13 ' A' ' 15' ' ' VAL . 3.8 mm? -57.13 -36.59 70.88 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.072 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.76 -45.08 4.66 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.127 0.489 . . . . 0.0 110.329 179.075 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 59.3 m-80 -67.32 -44.42 79.19 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.324 178.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.613 ' HG ' HD12 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -52.82 -35.6 57.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.065 179.791 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.506 ' HA ' ' HG ' ' A' ' 30' ' ' LEU . 26.7 m-70 -55.18 -31.66 61.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.641 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.475 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 6.4 mmpt? -94.38 -4.59 48.18 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -178.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 75' ' ' LEU . 3.5 m-80 -128.06 -13.82 5.04 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.567 ' CB ' HD12 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -60.65 -38.47 84.96 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.573 -179.916 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.467 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 33.3 t60 -175.2 -48.66 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.861 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 143.28 126.6 2.04 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.409 -0.9 . . . . 0.0 112.819 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 88.02 100.13 0.92 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.316 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.38 -26.03 4.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.717 0.294 . . . . 0.0 110.566 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -55.63 -30.02 60.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.507 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -86.97 -35.19 19.0 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.436 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.561 ' CD2' ' CD1' ' A' ' 23' ' ' TRP . 1.2 tm? -71.86 -32.87 67.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.874 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.412 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.1 OUTLIER -50.38 -36.24 31.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.846 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.72 -25.96 54.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.551 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 30' ' ' LEU . 2.8 p -89.8 -48.84 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.26 -179.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.492 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 2.3 t70 -69.08 -23.75 64.06 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 1.3 m120 -54.05 -36.14 62.76 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.186 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -33.52 75.43 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.309 178.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.41 ' O ' ' N ' ' A' ' 40' ' ' VAL . 0.1 OUTLIER -74.51 -64.25 1.07 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.24 179.184 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -46.23 -31.54 2.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.39 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.43 -28.51 59.38 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.919 0.39 . . . . 0.0 110.376 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.509 ' O ' HG12 ' A' ' 44' ' ' ILE . 53.3 t -73.4 -46.42 49.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.659 179.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 2.7 tp -45.47 -34.72 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.386 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.607 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 1.4 mt-10 -75.65 -30.95 59.62 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.646 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.532 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -82.8 -25.69 32.48 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.875 178.754 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 40' ' ' VAL . 31.0 mm -87.29 -47.53 15.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.678 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.607 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -70.97 -26.9 63.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.865 -178.957 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.504 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 69.3 m-20 -86.65 -40.72 14.84 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.07 0.462 . . . . 0.0 110.302 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.532 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 4.3 m-85 -72.3 -40.94 67.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.216 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 16.7 ptp -53.29 -26.9 20.23 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.817 0.341 . . . . 0.0 111.072 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -79.71 -1.4 38.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.436 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 120.04 18.38 4.27 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.863 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.403 ' O ' ' CD2' ' A' ' 47' ' ' PHE . . . -95.97 28.1 13.99 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.453 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.27 38.98 3.86 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.448 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.1 p -62.45 -25.68 68.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.773 0.321 . . . . 0.0 111.182 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.42 70.92 3.01 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.531 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.405 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . 150.19 -20.86 1.09 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.798 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.478 ' O ' ' CB ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.44 -46.0 9.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.618 0.246 . . . . 0.0 111.473 -179.814 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.559 ' O ' ' HB3' ' A' ' 61' ' ' MET . 13.7 tp -62.6 -9.28 8.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.301 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.487 ' O ' ' HG2' ' A' ' 61' ' ' MET . 16.9 pt20 -86.2 -50.83 6.69 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.815 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 17.4 mm-40 -87.66 -28.31 21.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.951 0.405 . . . . 0.0 110.302 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.478 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 9.3 tpp -78.23 -33.15 50.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.042 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.559 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 3.8 ptt? -55.44 -38.99 69.73 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.547 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.62 -15.57 62.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.898 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.403 ' HB3' HG23 ' A' ' 40' ' ' VAL . 75.0 tt0 -79.32 -25.4 42.35 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.732 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.503 ' CD2' ' O ' ' A' ' 61' ' ' MET . 2.0 p90 -86.95 -35.39 18.91 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.903 0.382 . . . . 0.0 110.467 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.478 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 0.0 OUTLIER -74.47 -31.2 62.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.545 179.294 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -57.91 -33.99 69.35 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.505 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.439 HG11 HG12 ' A' ' 33' ' ' VAL . 72.0 t -58.09 -47.09 87.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.079 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.506 ' HG ' HD23 ' A' ' 71' ' ' LEU . 1.3 mp -65.31 -14.68 61.33 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.269 178.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -66.37 -62.02 1.69 Allowed 'General case' 0 C--O 1.231 0.094 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.458 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 14.4 tp10 -50.82 -32.1 19.1 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.787 0.804 . . . . 0.0 109.314 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.613 HD12 ' HG ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -74.52 -69.41 0.46 Allowed 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 113.979 -1.464 . . . . 0.0 112.232 -178.939 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -49.49 -26.3 3.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.702 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.64 6.26 28.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.557 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.593 ' O ' ' N ' ' A' ' 76' ' ' GLN . 66.6 m-70 -152.15 32.71 0.53 Allowed 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.565 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -54.65 83.28 0.0 OUTLIER 'General case' 0 CA--C 1.521 -0.135 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.789 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.593 ' N ' ' O ' ' A' ' 74' ' ' HIS . 1.0 OUTLIER -83.9 -34.07 24.62 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.947 -177.425 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -83.85 -66.45 1.49 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.615 -0.802 . . . . 0.0 113.062 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -174.35 116.88 0.6 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.115 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.565 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -44.28 -29.78 0.71 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.634 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -45.58 -30.81 1.6 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.838 0.352 . . . . 0.0 111.032 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.529 ' O ' HG21 ' A' ' 85' ' ' ILE . 1.2 m -69.93 -74.4 0.14 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.534 ' HA ' HG12 ' A' ' 85' ' ' ILE . 22.2 t -48.92 -40.88 12.8 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.384 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.034 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.481 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -48.97 -41.31 33.78 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.089 0.471 . . . . 0.0 109.737 179.541 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.413 ' O ' ' HB3' ' A' ' 88' ' ' ASN . 0.6 OUTLIER -76.25 -27.58 56.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.696 178.865 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.534 HG12 ' HA ' ' A' ' 82' ' ' VAL . 0.2 OUTLIER -85.61 -36.16 10.48 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.165 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.151 -179.611 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.481 ' CG ' ' HA ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -71.93 -43.68 64.88 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.213 -0.292 . . . . 0.0 110.213 179.433 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -62.41 -29.46 70.51 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.451 ' ND2' ' N ' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -82.92 -57.3 3.35 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.305 179.122 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.486 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -61.56 -48.23 89.73 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.374 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.97 -179.616 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.434 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 20.6 tptp -61.46 -28.57 69.38 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 120.291 -0.564 . . . . 0.0 109.494 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -90.73 -2.24 57.82 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.094 178.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.454 ' HB ' ' HA ' ' A' ' 89' ' ' ILE . 1.0 OUTLIER -78.62 -43.27 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.355 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.637 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -54.97 -26.64 37.98 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.149 178.692 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.637 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.1 OUTLIER -62.87 -65.73 0.64 Allowed 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.84 -179.523 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.15 -12.1 7.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.108 178.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 55.5 mt -89.29 -65.7 0.99 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.529 179.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.432 ' N ' HD21 ' A' ' 57' ' ' LEU . 4.2 mm-40 -63.09 -16.36 59.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.17 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 94' ' ' HIS . 56.6 tt0 -87.83 -10.73 49.95 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.745 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.435 HD13 ' CG ' ' A' ' 2' ' ' TYR . 30.0 tp -81.4 -57.18 3.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.644 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 41.1 t -62.35 -31.13 50.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.276 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -69.4 -40.61 77.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.919 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.293 -0.861 . . . . 0.0 110.921 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.8 mmt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.785 0.326 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -73.65 123.17 23.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.977 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -179.83 -34.65 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.488 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 tptm -59.96 -17.44 38.09 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 116.611 0.205 . . . . 0.0 110.928 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.429 ' HB2' HD12 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -49.27 -25.56 2.43 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.111 -0.699 . . . . 0.0 109.111 178.041 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -59.29 -41.2 88.39 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.832 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -50.42 -31.45 15.04 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.204 0.526 . . . . 0.0 110.001 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -83.49 -30.61 27.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.024 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.451 ' O ' HD23 ' A' ' 12' ' ' LEU . 8.8 mt -60.79 -42.78 98.25 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.555 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -45.5 -40.05 8.05 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.487 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -54.65 -43.02 72.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.987 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.455 HD12 HG13 ' A' ' 89' ' ' ILE . 0.0 OUTLIER -56.57 -63.36 1.22 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.534 179.805 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.456 ' HA ' HD23 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -52.41 -37.77 57.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.314 -179.14 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -75.18 -26.73 59.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.941 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.484 HG13 ' HB ' ' A' ' 85' ' ' ILE . 0.5 OUTLIER -68.89 -28.52 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.09 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.598 ' O ' HD21 ' A' ' 19' ' ' LEU . 1.6 mm? -67.48 -34.63 77.55 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.312 179.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 ttpp -40.45 -33.94 0.3 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.151 0.501 . . . . 0.0 110.515 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.404 ' HB3' ' CG2' ' A' ' 81' ' ' THR . 2.2 m-20 -81.18 -41.53 22.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.905 178.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.688 ' HG ' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -51.72 -29.93 20.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.128 179.722 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.57 ' N ' HD23 ' A' ' 19' ' ' LEU . 76.2 m-70 -62.19 -37.51 85.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.021 0.439 . . . . 0.0 110.836 -179.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.531 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 4.3 mmpt? -94.5 16.85 14.29 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.034 -178.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -145.41 -20.12 0.48 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.624 ' HB2' ' CD1' ' A' ' 71' ' ' LEU . 0.6 OUTLIER -63.75 -27.66 69.35 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 119.719 -0.793 . . . . 0.0 110.959 -179.608 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.435 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 86.2 t60 -178.86 -53.13 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.889 0.376 . . . . 0.0 110.643 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 141.68 126.83 2.2 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.874 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 90.9 94.63 1.26 Allowed Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.107 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.82 -26.65 1.72 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.753 0.311 . . . . 0.0 110.591 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -53.8 -32.25 51.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.484 179.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -86.25 -42.37 13.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.329 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.663 ' HG ' HD23 ' A' ' 19' ' ' LEU . 1.5 tm? -62.05 -35.89 79.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.838 179.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.439 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 45.3 t60 -46.61 -35.35 5.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.404 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.61 -24.1 53.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.689 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.516 HG13 ' O ' ' A' ' 30' ' ' LEU . 2.7 p -91.87 -47.17 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.438 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.493 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 6.7 t70 -71.63 -23.98 61.79 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.086 179.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.439 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 11.3 t30 -54.33 -30.69 52.18 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.0 -32.21 71.6 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.851 178.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.438 ' HG ' HD22 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -75.39 -64.52 1.05 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.434 179.427 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.436 ' CG ' ' HA ' ' A' ' 35' ' ' ASN . 1.5 pt20 -47.08 -28.53 1.76 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.298 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -76.33 -28.36 56.87 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.91 0.386 . . . . 0.0 110.351 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.57 ' O ' HG12 ' A' ' 44' ' ' ILE . 78.6 t -75.92 -43.3 39.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.504 179.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.406 HG22 ' N ' ' A' ' 42' ' ' GLU . 4.7 tp -46.5 -33.11 1.84 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.13 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.056 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.559 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 1.6 mt-10 -75.57 -30.59 59.72 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.081 179.093 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.601 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 43.2 m-20 -82.79 -25.41 32.76 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.835 178.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 40' ' ' VAL . 17.1 mm -86.9 -53.05 10.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.098 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.559 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -64.58 -27.71 69.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.23 -179.657 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.511 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 25.9 t0 -86.63 -46.8 9.75 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 120.907 0.384 . . . . 0.0 110.501 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.601 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.5 m-30 -66.5 -23.24 66.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.567 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.8 -26.01 13.11 Favored 'General case' 0 C--N 1.334 -0.109 0 CA-C-O 120.888 0.375 . . . . 0.0 110.635 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -90.9 9.45 30.36 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.367 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.58 -2.15 58.75 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.694 -0.765 . . . . 0.0 113.082 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.36 -41.28 31.84 Favored Glycine 0 C--N 1.333 0.39 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.167 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.444 ' HA3' ' CE2' ' A' ' 47' ' ' PHE . . . -163.74 24.73 0.19 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.178 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.59 -168.32 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.883 0.373 . . . . 0.0 110.764 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 88.65 -62.02 3.76 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.77 -0.728 . . . . 0.0 113.041 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . -124.57 11.55 7.96 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.386 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.572 ' HE3' ' CD2' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -88.43 -44.23 10.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 117.034 0.417 . . . . 0.0 111.249 179.858 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.487 ' O ' ' CB ' ' A' ' 61' ' ' MET . 0.1 OUTLIER -59.32 -14.09 10.32 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.872 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 55' ' ' GLY . 27.1 pt20 -85.9 -50.62 6.96 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.34 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -85.87 -29.81 23.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.864 0.364 . . . . 0.0 110.655 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.425 ' CG ' ' HD3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -78.3 -31.78 49.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.995 179.796 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.487 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.1 OUTLIER -56.86 -40.47 76.21 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.489 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.97 -19.44 61.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.929 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -76.46 -31.86 58.06 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.543 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.482 ' CD2' ' HA ' ' A' ' 61' ' ' MET . 1.1 p90 -87.04 -25.86 24.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.88 0.371 . . . . 0.0 110.456 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -82.13 -30.96 30.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.417 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -58.48 -36.7 74.14 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.416 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.412 ' CG2' ' O ' ' A' ' 33' ' ' VAL . 83.4 t -54.19 -42.89 58.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.422 179.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.542 ' CD2' HG13 ' A' ' 85' ' ' ILE . 0.5 OUTLIER -74.09 -14.28 60.96 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.512 179.142 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.67 -52.19 53.53 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -57.65 -24.57 57.26 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.528 0.68 . . . . 0.0 109.709 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.688 HD11 ' HG ' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -70.45 -65.27 0.75 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.734 -1.121 . . . . 0.0 112.818 -178.826 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -46.53 -21.7 0.21 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.418 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.407 ' N ' ' C ' ' A' ' 71' ' ' LEU . 45.7 m-20 -83.56 -23.85 31.84 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.135 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.53 ' CB ' ' O ' ' A' ' 23' ' ' TRP . 44.1 m-70 -135.94 33.2 2.91 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 119.234 -0.986 . . . . 0.0 112.993 -179.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.513 ' CD1' HG23 ' A' ' 82' ' ' VAL . 0.0 OUTLIER -51.92 92.08 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 177.587 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.484 ' N ' ' O ' ' A' ' 74' ' ' HIS . 41.9 tp60 -64.3 69.14 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.55 -178.017 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 52.74 25.49 22.4 Favored Glycine 0 N--CA 1.453 -0.176 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.716 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -126.7 40.01 1.87 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.426 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.439 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -48.9 -31.47 7.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.638 0.256 . . . . 0.0 111.215 -179.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -58.25 -31.72 67.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.042 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.582 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.2 m -68.02 -74.56 0.12 Allowed 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.513 HG23 ' CD1' ' A' ' 75' ' ' LEU . 12.6 t -49.09 -40.93 13.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.95 179.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.489 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 7.0 m170 -49.33 -41.86 39.86 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.189 0.519 . . . . 0.0 109.776 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -76.27 -27.07 56.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.622 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.582 HG22 ' O ' ' A' ' 81' ' ' THR . 0.2 OUTLIER -85.25 -36.34 10.94 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.9 -179.865 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.489 ' CG ' ' HA ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -71.11 -45.82 62.89 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.164 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.04 -29.74 67.52 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.4 ' O ' ' CD1' ' A' ' 92' ' ' ILE . 1.8 m-80 -82.96 -67.61 0.77 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.505 179.147 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.46 ' HA ' ' HB ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -52.84 -47.83 51.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.511 -179.591 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.3 -29.26 70.31 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.28 -0.568 . . . . 0.0 109.662 179.647 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -90.78 -4.0 56.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.168 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.46 ' HB ' ' HA ' ' A' ' 89' ' ' ILE . 1.1 mp -78.58 -44.59 25.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.628 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -52.39 -29.19 22.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.536 179.149 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.628 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 38.1 t-80 -61.57 -65.36 0.7 Allowed 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.109 -179.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.9 m170 -62.44 -9.56 8.82 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.369 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 30.9 mt -89.3 -63.46 1.29 Allowed 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 120.956 0.408 . . . . 0.0 110.456 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -67.56 -12.25 59.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.219 179.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 94' ' ' HIS . 11.2 mm-40 -87.92 -26.42 22.72 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 120.912 0.386 . . . . 0.0 110.377 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.429 HD12 ' HB2' ' A' ' 5' ' ' LEU . 11.3 tp -66.83 -56.84 8.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.92 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 31.9 t -63.56 -39.94 87.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.423 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -60.9 -33.04 72.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.837 0.351 . . . . 0.0 111.006 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.838 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 ptp . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.796 0.331 . . . . 0.0 111.204 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -99.32 54.61 0.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.889 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -119.53 -25.74 2.56 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.84 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -63.2 -17.63 62.62 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.61 0.205 . . . . 0.0 111.105 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.41 ' CD2' HD12 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -51.17 -24.02 3.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.046 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.412 ' N ' ' CE ' ' A' ' 48' ' ' MET . 33.6 p-10 -59.61 -41.13 89.66 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.896 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -48.24 -32.59 7.4 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.22 0.533 . . . . 0.0 110.048 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -87.4 -30.3 20.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.295 179.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.403 ' O ' HD21 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -68.92 -34.94 76.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.359 179.799 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -52.96 -43.06 66.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.302 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.41 -41.31 28.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.927 0.394 . . . . 0.0 111.001 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.468 ' O ' HG12 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -57.36 -61.22 2.63 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.6 179.833 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.467 ' HA ' HD21 ' A' ' 16' ' ' LEU . 7.5 tm0? -51.28 -38.04 50.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.047 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -75.67 -28.47 58.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.905 179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.502 ' CG2' ' HA ' ' A' ' 85' ' ' ILE . 0.3 OUTLIER -68.18 -31.08 50.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.983 179.19 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.467 HD21 ' HA ' ' A' ' 13' ' ' GLN . 3.4 mm? -60.5 -37.38 80.92 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.207 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.2 ttpt -41.78 -41.91 2.48 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.033 0.444 . . . . 0.0 110.554 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.9 -43.77 67.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.759 178.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.644 ' HG ' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -50.42 -44.0 55.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.572 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.529 ' CE1' ' CD1' ' A' ' 30' ' ' LEU . 78.5 m-70 -49.33 -31.3 8.96 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.483 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 6.2 mmpt? -94.24 -9.86 34.79 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -177.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.481 ' HB2' ' CG2' ' A' ' 81' ' ' THR . 4.8 m120 -126.37 3.82 6.99 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -179.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.682 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -77.06 -54.05 7.03 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.752 179.833 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.504 ' N ' ' CG ' ' A' ' 23' ' ' TRP . 8.7 t-160 179.39 57.6 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.921 0.391 . . . . 0.0 111.027 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 118.21 -107.5 1.48 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.302 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -124.65 -146.2 6.81 Favored Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.167 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.454 ' CD ' ' CE1' ' A' ' 20' ' ' HIS . 17.3 ttpp -94.11 -11.13 31.18 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -50.41 -65.45 0.56 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -178.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -75.14 -25.39 58.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.567 0.222 . . . . 0.0 111.111 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.682 ' HB2' ' CD1' ' A' ' 23' ' ' TRP . 2.0 tm? -72.99 -29.15 62.82 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.437 ' N ' ' O ' ' A' ' 27' ' ' LYS . 28.3 t60 -47.71 -51.85 20.51 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.527 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.11 -22.48 66.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.887 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.469 ' CG1' ' CG1' ' A' ' 67' ' ' VAL . 1.2 t -85.82 -62.25 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.864 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.481 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 1.3 t0 -59.42 -25.26 64.18 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 1.3 m120 -56.41 -39.42 72.99 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 177.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.13 -45.85 83.39 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 177.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.477 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -53.51 -69.69 0.11 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.619 178.623 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -46.48 -43.55 16.79 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.038 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -54.99 -26.22 35.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.05 0.452 . . . . 0.0 110.243 179.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.505 ' O ' HG12 ' A' ' 44' ' ' ILE . 32.5 t -74.36 -57.52 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.374 179.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.579 HG22 ' N ' ' A' ' 42' ' ' GLU . 0.5 OUTLIER -44.49 -35.71 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.79 -179.766 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.623 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 3.8 pt-20 -75.64 -30.29 59.41 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.829 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.528 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 2.1 m-20 -84.08 -27.56 28.17 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.885 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.505 HG12 ' O ' ' A' ' 40' ' ' VAL . 25.3 mm -86.99 -48.43 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.497 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.623 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -68.96 -26.83 65.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.276 -179.631 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.524 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 14.0 t70 -86.48 -41.91 14.0 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.071 0.463 . . . . 0.0 110.226 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.528 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.4 m-85 -72.14 -23.72 61.34 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.606 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.429 ' CG ' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -54.01 -34.6 60.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.981 179.752 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -73.77 -22.46 59.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.422 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 146.14 -11.8 1.61 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.428 -0.892 . . . . 0.0 113.082 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.36 -26.44 4.97 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.71 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 154.03 44.61 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.256 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.8 t -59.53 -29.65 68.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.731 0.3 . . . . 0.0 111.03 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.23 72.03 2.05 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.191 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.442 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . 149.03 -19.79 1.23 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.575 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.448 ' O ' ' CB ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.64 -46.01 9.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.663 0.268 . . . . 0.0 111.279 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.508 ' O ' ' CB ' ' A' ' 61' ' ' MET . 5.7 tp -61.79 -10.84 9.95 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 1.6 pp0? -85.88 -50.98 6.69 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.939 179.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -86.88 -30.8 21.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.997 0.427 . . . . 0.0 110.382 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.448 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -76.39 -29.52 57.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.616 179.637 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.508 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 2.9 tmm? -55.66 -44.69 77.47 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 121.015 0.436 . . . . 0.0 110.509 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -12.82 60.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.181 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -83.2 -24.75 32.28 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.535 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.469 ' CD2' ' O ' ' A' ' 61' ' ' MET . 1.6 p90 -87.08 -35.38 18.74 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.902 0.382 . . . . 0.0 110.427 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.458 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 0.0 OUTLIER -79.17 -30.97 43.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.96 179.757 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -58.92 -34.93 72.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.019 0.438 . . . . 0.0 110.407 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.477 ' CG2' ' HB2' ' A' ' 37' ' ' LEU . 80.5 t -57.65 -44.05 84.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.418 179.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.51 ' CD2' HG13 ' A' ' 85' ' ' ILE . 0.9 OUTLIER -70.44 -9.21 55.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.611 178.799 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -71.45 -57.99 3.92 Favored 'General case' 0 C--O 1.231 0.098 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.583 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 3.5 tp10 -53.38 -37.48 62.47 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.949 0.88 . . . . 0.0 108.996 177.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.644 HD11 ' HG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -70.86 -68.34 0.44 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.72 -1.582 . . . . 0.0 112.04 -179.32 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 22.5 t30 -49.3 -25.59 2.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.924 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -85.28 4.17 36.15 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.656 ' O ' ' N ' ' A' ' 76' ' ' GLN . 72.2 m-70 -150.9 32.03 0.62 Allowed 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.594 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -50.27 82.76 0.0 OUTLIER 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.912 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.656 ' N ' ' O ' ' A' ' 74' ' ' HIS . 4.5 tt0 -84.18 -34.32 24.0 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.675 -177.512 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -88.1 -20.34 49.91 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.7 -0.762 . . . . 0.0 113.009 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 130.82 130.24 3.16 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.256 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.594 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -52.76 -19.44 2.45 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -179.824 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -48.6 -39.24 23.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.696 0.284 . . . . 0.0 111.32 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.496 ' O ' HG23 ' A' ' 85' ' ' ILE . 1.2 m -69.55 -74.15 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 178.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.575 ' O ' ' N ' ' A' ' 86' ' ' GLU . 25.8 t -47.77 -36.8 5.5 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.414 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.084 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.484 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 57.0 t-80 -52.45 -41.08 62.97 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -76.17 -28.26 57.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.459 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.558 ' O ' ' HB ' ' A' ' 89' ' ' ILE . 0.2 OUTLIER -85.61 -33.15 7.45 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.196 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.054 -179.728 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.575 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -75.95 -44.69 38.74 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.059 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -60.85 -29.97 69.84 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.406 ' O ' ' CD1' ' A' ' 92' ' ' ILE . 2.0 m-80 -82.89 -63.19 1.41 Allowed 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.065 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.558 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -54.5 -48.51 69.79 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.186 179.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.416 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 0.1 OUTLIER -60.88 -29.55 69.62 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.6 179.658 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -90.8 -3.44 57.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.371 178.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.459 ' HB ' ' HA ' ' A' ' 89' ' ' ILE . 1.1 mp -78.65 -39.05 22.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.62 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -60.45 -25.07 65.72 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.25 178.689 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.62 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 8.9 t-80 -60.56 -65.91 0.61 Allowed 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.222 -179.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 63.7 m80 -63.67 -9.32 13.36 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.48 178.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 55.2 mt -89.48 -59.7 2.14 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.127 0.489 . . . . 0.0 110.543 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.417 ' HA ' ' CD2' ' A' ' 57' ' ' LEU . 5.4 mt-10 -66.61 -11.96 55.83 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.382 179.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.508 ' HB2' ' O ' ' A' ' 94' ' ' HIS . 8.8 tt0 -94.68 3.71 54.73 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.723 0.297 . . . . 0.0 111.111 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.429 ' CD2' ' CG ' ' A' ' 48' ' ' MET . 8.1 tp -101.66 -47.48 4.62 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.966 0.412 . . . . 0.0 110.669 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 41.2 t -76.89 -34.12 22.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.124 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -98.33 31.33 2.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.943 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.6 tpt85 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.958 179.98 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 tpp . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.79 0.328 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -92.38 137.8 32.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.866 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.508 ' HA2' ' HG3' ' A' ' 48' ' ' MET . . . 157.6 -23.14 0.42 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.581 -0.819 . . . . 0.0 112.99 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.45 -18.62 61.68 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 116.654 0.227 . . . . 0.0 111.056 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.432 ' CD2' HD12 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -53.14 -21.76 5.42 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.061 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.405 ' CB ' ' HB2' ' A' ' 45' ' ' HIS . 38.5 p-10 -61.39 -40.18 93.4 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.815 179.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -51.38 -28.44 12.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.086 0.469 . . . . 0.0 110.012 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.421 ' CD1' HG13 ' A' ' 92' ' ' ILE . 0.5 OUTLIER -83.86 -29.38 27.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.002 179.22 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.408 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 10.3 mt -63.79 -30.61 71.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.049 0.452 . . . . 0.0 110.792 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -54.46 -51.28 65.52 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.549 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -51.25 -49.55 60.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.885 0.374 . . . . 0.0 111.33 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.468 ' HG ' ' N ' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -56.51 -60.82 2.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.615 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.515 ' HA ' HD23 ' A' ' 16' ' ' LEU . 2.4 tt0 -53.85 -35.28 61.31 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.037 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -77.98 -26.03 48.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.228 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.446 ' CG2' ' HA ' ' A' ' 85' ' ' ILE . 0.5 OUTLIER -70.5 -27.56 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.401 179.314 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.515 HD23 ' HA ' ' A' ' 13' ' ' GLN . 3.0 mm? -61.1 -36.66 80.28 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.313 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.555 ' HA ' ' CD2' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -48.68 -40.54 28.52 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.105 0.479 . . . . 0.0 110.096 179.478 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.92 -39.17 76.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.515 178.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.625 ' HG ' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -55.74 -53.53 55.45 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.842 -179.662 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.561 ' CA ' ' HG ' ' A' ' 30' ' ' LEU . 2.2 p80 -53.93 -15.44 1.37 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -178.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.616 ' HA ' ' CE ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -92.85 -24.12 18.59 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.674 -179.815 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -130.8 28.71 4.82 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.832 0.349 . . . . 0.0 111.061 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.548 ' CB ' HD11 ' A' ' 71' ' ' LEU . 2.4 p-90 -88.99 -31.84 17.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.739 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.482 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 79.7 t60 -177.9 -52.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.652 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 168.04 120.19 0.51 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.568 -0.825 . . . . 0.0 113.105 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 61.97 128.51 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.838 179.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.428 ' HD2' ' CD2' ' A' ' 20' ' ' HIS . 7.6 tttt -64.11 -16.26 61.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.597 0.237 . . . . 0.0 110.917 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -44.94 -48.98 11.34 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.483 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -77.44 -39.45 46.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.482 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.561 ' HG ' ' CA ' ' A' ' 20' ' ' HIS . 1.8 tm? -59.81 -28.2 67.25 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.425 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 1.4 t60 -46.39 -58.73 3.47 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.306 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.43 -21.88 60.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.746 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.535 ' CG1' HG13 ' A' ' 67' ' ' VAL . 2.2 t -83.41 -65.26 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.846 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.444 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 1.3 t0 -61.37 -25.03 66.89 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.369 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.425 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 16.2 t-20 -58.77 -41.15 85.92 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 177.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.419 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -64.72 -46.95 80.09 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 177.171 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.446 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -51.44 -68.48 0.17 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.945 178.521 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -46.66 -41.77 15.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.133 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -59.25 -26.54 64.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.24 179.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.447 ' O ' HG13 ' A' ' 44' ' ' ILE . 14.9 t -70.92 -52.89 24.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.404 179.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.412 ' CD1' HD11 ' A' ' 37' ' ' LEU . 1.8 mp -46.07 -38.64 3.13 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.535 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.608 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 1.5 pt-20 -72.91 -28.74 62.65 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 120.747 0.308 . . . . 0.0 110.802 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.564 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 6.0 m-20 -84.14 -28.31 27.53 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.49 HD13 HG23 ' A' ' 44' ' ' ILE . 34.3 mt -86.56 -52.48 11.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.335 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.608 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -63.27 -26.76 68.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.727 -179.943 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.513 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 13.5 t70 -86.68 -36.68 18.59 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.026 0.441 . . . . 0.0 110.01 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.564 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.2 m-85 -74.22 -42.1 60.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.28 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.508 ' HG3' ' HA2' ' A' ' 3' ' ' GLY . 12.1 ptp -51.73 -24.09 5.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.331 -179.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -88.71 9.29 24.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.516 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 111.27 20.36 7.1 Favored Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.991 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -96.45 26.95 19.3 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.706 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.87 29.82 7.08 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.608 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.31 -12.92 59.37 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.514 0.19 . . . . 0.0 111.514 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -83.16 71.63 2.98 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.668 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.407 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . 131.1 -9.45 5.68 Favored Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.803 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.49 ' HE3' ' CG ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -88.51 -34.38 17.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.668 0.27 . . . . 0.0 111.295 -179.749 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.511 ' O ' ' CB ' ' A' ' 61' ' ' MET . 0.1 OUTLIER -65.51 -11.58 44.77 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -179.197 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 55' ' ' GLY . 15.1 pt20 -86.47 -50.03 7.17 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.547 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 71.4 mt-10 -85.54 -31.02 22.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.835 0.35 . . . . 0.0 110.783 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.448 ' CG ' ' HD3' ' A' ' 56' ' ' LYS . 0.8 OUTLIER -78.11 -33.09 50.75 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.902 179.768 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.511 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 4.5 tmm? -55.37 -39.17 69.77 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.562 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.84 -17.27 62.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.967 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.434 ' HB3' HG22 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -78.95 -31.36 45.05 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.624 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.433 ' CZ ' HG23 ' A' ' 92' ' ' ILE . 0.8 OUTLIER -87.27 -24.49 24.34 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.192 0.52 . . . . 0.0 109.597 179.351 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -83.02 -33.39 26.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.164 178.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -55.48 -38.44 69.12 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.904 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.535 HG13 ' CG1' ' A' ' 33' ' ' VAL . 3.9 t -51.57 -44.39 33.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.109 0.48 . . . . 0.0 110.285 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.51 ' HA ' HD22 ' A' ' 71' ' ' LEU . 0.9 OUTLIER -68.4 -6.71 26.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.003 179.302 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -75.85 -59.89 2.56 Favored 'General case' 0 C--N 1.338 0.092 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.449 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -48.44 -40.7 27.04 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 122.391 1.091 . . . . 0.0 108.564 177.447 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.625 HD11 ' HG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -70.74 -68.12 0.45 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 112.904 -1.953 . . . . 0.0 112.029 -179.421 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -51.15 -26.08 6.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.346 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -87.91 9.21 22.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.265 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.491 ' O ' ' N ' ' A' ' 76' ' ' GLN . 14.2 m-70 -158.68 35.63 0.22 Allowed 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.482 ' CD1' HG21 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -54.67 88.44 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.198 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 74' ' ' HIS . 3.6 tp60 -63.76 69.25 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.384 -178.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.439 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 57.11 30.68 61.0 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.401 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -130.62 39.12 1.84 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.587 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -49.47 -32.03 11.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.697 0.284 . . . . 0.0 111.26 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -63.18 -31.53 72.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.135 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.489 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.9 m -67.49 -72.57 0.16 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.908 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 86' ' ' GLU . 42.9 t -51.48 -39.1 21.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.852 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.491 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.3 OUTLIER -46.6 -41.23 14.21 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 179.226 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -76.27 -29.73 57.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.729 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.506 HG12 ' HA ' ' A' ' 82' ' ' VAL . 0.2 OUTLIER -85.38 -30.44 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.106 -179.675 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.3 OUTLIER -79.76 -46.51 16.86 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.929 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 1.7 mp0 -59.59 -27.51 66.34 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 177.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.663 ' O ' HD11 ' A' ' 92' ' ' ILE . 1.6 m-80 -82.71 -69.17 0.65 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.811 178.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.493 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -49.84 -39.39 15.01 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.445 -179.964 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.504 ' O ' ' CD2' ' A' ' 93' ' ' PHE . 28.5 mmmt -63.54 -23.55 67.43 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 119.89 -0.724 . . . . 0.0 110.002 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -90.54 -8.75 49.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.177 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.663 HD11 ' O ' ' A' ' 88' ' ' ASN . 1.2 mp -78.75 -56.31 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.977 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.504 ' CD2' ' O ' ' A' ' 90' ' ' LYS . 0.6 OUTLIER -45.72 -44.56 13.75 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.726 179.669 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.485 ' N ' ' CG ' ' A' ' 93' ' ' PHE . 9.3 t-160 -57.52 -61.43 2.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.789 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -61.54 -11.97 13.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.502 178.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 18.7 mt -89.18 -65.55 1.01 Allowed 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.972 0.415 . . . . 0.0 110.599 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -65.71 -13.31 59.03 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.114 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.478 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 4.4 tp10 -87.07 -26.94 23.44 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-O 120.938 0.399 . . . . 0.0 110.306 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.432 HD12 ' CD2' ' A' ' 5' ' ' LEU . 18.8 tp -66.19 -57.74 6.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.634 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 33.5 t -64.15 -37.66 80.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.21 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -60.91 -43.15 98.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.896 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.852 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mtt . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.838 0.351 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -76.17 144.72 40.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.725 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.562 ' HA2' ' HG3' ' A' ' 48' ' ' MET . . . 177.1 -34.55 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.726 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.4 tptm -63.85 -17.43 63.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.481 0.181 . . . . 0.0 111.044 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.428 ' HB2' HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -52.38 -22.9 5.12 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.198 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.424 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 26.3 p-10 -56.95 -46.38 82.16 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.02 179.266 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -49.43 -32.16 11.2 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.089 0.471 . . . . 0.0 110.209 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -87.85 -26.65 22.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.384 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 1.0 OUTLIER -74.41 -40.94 61.68 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.748 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -49.3 -42.05 40.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.638 -179.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -50.41 -42.32 53.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.129 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.504 ' O ' HG13 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -59.57 -62.53 1.81 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.678 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.438 ' HA ' HD22 ' A' ' 16' ' ' LEU . 4.0 tt0 -51.17 -35.45 36.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.977 -179.339 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -77.39 -30.92 53.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.953 179.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.504 HG13 ' O ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -63.68 -32.48 57.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.831 179.033 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.481 ' N ' HG12 ' A' ' 15' ' ' VAL . 3.6 mm? -59.45 -36.52 76.1 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.396 179.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.9 ttpt -43.02 -42.55 3.89 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.038 0.447 . . . . 0.0 110.291 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -70.35 -44.96 67.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.7 178.673 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.63 ' HG ' HD12 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -48.03 -41.49 25.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.421 -179.969 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.511 ' CB ' ' HE3' ' A' ' 21' ' ' LYS . 50.0 m-70 -51.69 -35.01 41.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.927 -179.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.511 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.0 mmpt? -92.34 1.81 57.01 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -177.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -142.1 10.64 1.95 Allowed 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.385 -0.526 . . . . 0.0 112.323 -179.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.691 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -81.53 -36.88 28.64 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.809 179.734 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.482 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 86.3 t60 -179.99 -52.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.877 0.37 . . . . 0.0 110.672 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 154.71 149.72 5.34 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.536 -0.84 . . . . 0.0 113.046 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.13 103.66 0.01 OUTLIER Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.555 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -54.14 -23.01 12.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.756 0.313 . . . . 0.0 110.696 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.73 -32.97 21.15 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.858 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -85.27 -47.57 9.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.453 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.691 ' HB2' ' CD1' ' A' ' 23' ' ' TRP . 2.2 tm? -59.53 -29.69 68.07 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.416 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 0.4 OUTLIER -45.75 -56.45 5.29 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.685 179.738 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.92 -20.24 63.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.932 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.472 HG11 ' CG1' ' A' ' 67' ' ' VAL . 1.3 t -87.34 -62.75 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.762 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.487 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -60.99 -24.91 66.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.93 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.416 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 1.5 t30 -58.64 -39.87 81.76 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 177.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.402 ' O ' ' CG2' ' A' ' 40' ' ' VAL . 0.2 OUTLIER -61.68 -51.47 68.29 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.588 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.478 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -53.94 -68.12 0.21 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.965 178.651 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 14.6 tm0? -46.81 -40.08 13.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.741 -179.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -69.01 -22.96 64.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.965 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.402 ' CG2' ' O ' ' A' ' 36' ' ' HIS . 66.5 t -78.33 -38.83 23.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.485 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.413 HG22 ' N ' ' A' ' 42' ' ' GLU . 1.1 tp -48.1 -34.64 4.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.412 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.413 ' N ' HG22 ' A' ' 41' ' ' ILE . 4.0 pt-20 -75.69 -37.33 59.62 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 120.967 0.413 . . . . 0.0 109.902 179.197 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.524 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -62.47 -30.59 71.36 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.637 178.768 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.459 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -86.85 -35.26 8.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.581 179.128 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.404 ' CD2' ' O ' ' A' ' 41' ' ' ILE . 23.5 m170 -70.19 -42.12 72.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.738 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.25 -21.76 53.23 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.998 178.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.524 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.3 m-85 -88.64 -45.25 10.0 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.985 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.562 ' HG3' ' HA2' ' A' ' 3' ' ' GLY . 14.6 ptt? -49.79 -24.76 2.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.723 0.297 . . . . 0.0 111.488 -179.492 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 mm100 -90.61 15.29 11.23 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.534 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 102.54 26.13 7.39 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.867 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -104.07 31.51 8.58 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.649 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.35 23.94 7.76 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.769 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 55.0 p -59.74 -20.2 55.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.673 0.273 . . . . 0.0 111.408 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -93.5 76.69 1.1 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.417 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.438 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . 135.53 -12.28 4.3 Favored Glycine 0 N--CA 1.453 -0.184 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.365 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.5 ' O ' ' HB3' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.4 -53.31 4.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.909 0.385 . . . . 0.0 110.593 179.589 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.487 ' O ' ' CB ' ' A' ' 61' ' ' MET . 0.5 OUTLIER -54.48 -11.52 0.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.224 -179.553 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -85.53 -51.89 6.2 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.162 179.845 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.98 -26.96 23.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.951 0.405 . . . . 0.0 110.251 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.5 ' HB3' ' O ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -77.67 -36.53 51.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.273 179.464 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.487 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 1.4 tmt? -50.4 -39.12 46.12 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.911 0.386 . . . . 0.0 110.705 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.89 -22.17 66.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.206 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.4 -42.4 53.85 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -179.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.443 ' HE1' HG23 ' A' ' 89' ' ' ILE . 1.0 OUTLIER -73.52 -24.53 60.16 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.121 0.486 . . . . 0.0 110.157 -179.989 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -82.77 -31.96 28.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.081 178.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -37.24 74.43 Favored 'General case' 0 C--O 1.231 0.079 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.674 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.478 ' CG2' ' HB2' ' A' ' 37' ' ' LEU . 84.9 t -54.29 -39.49 43.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.474 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.525 ' CD2' HG13 ' A' ' 85' ' ' ILE . 1.0 OUTLIER -75.84 -4.88 43.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.524 178.651 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -76.04 -56.81 4.31 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.565 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 7.9 tp10 -53.38 -38.04 62.99 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 122.098 0.951 . . . . 0.0 108.536 177.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.63 HD12 ' HG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -72.77 -67.17 0.58 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 113.485 -1.689 . . . . 0.0 111.939 -179.402 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.424 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 23.2 t-20 -50.68 -26.04 5.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.447 -179.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 21.9 m-20 -87.68 7.77 28.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.517 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.514 ' O ' ' N ' ' A' ' 76' ' ' GLN . 72.9 m-70 -154.09 31.92 0.44 Allowed 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.454 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -50.32 90.27 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.289 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -66.25 68.85 0.06 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.417 -177.997 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 58.44 24.78 56.81 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.75 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -130.96 46.23 1.09 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.236 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.454 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.2 OUTLIER -55.41 -32.5 62.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.693 0.283 . . . . 0.0 111.296 -179.697 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 37.4 p-80 -57.47 -33.43 67.97 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.052 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.597 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.2 m -67.15 -74.36 0.12 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.497 ' CG1' ' CD2' ' A' ' 71' ' ' LEU . 29.1 t -50.66 -42.06 21.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.2 179.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.478 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 42.4 t60 -48.83 -41.09 31.81 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.406 ' O ' ' HB3' ' A' ' 88' ' ' ASN . 84.7 t60 -76.47 -27.58 56.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.752 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.597 HG22 ' O ' ' A' ' 81' ' ' THR . 0.2 OUTLIER -85.48 -33.1 7.48 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.149 -179.63 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.481 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -74.38 -45.71 45.1 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 179.102 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.415 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -59.14 -29.9 67.75 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 177.943 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.462 ' ND2' ' N ' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -83.08 -58.63 2.77 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.494 179.344 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.503 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -60.57 -48.13 89.88 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.359 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.396 -179.313 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.414 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 0.6 OUTLIER -61.5 -29.11 69.77 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 120.124 -0.631 . . . . 0.0 109.818 179.784 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -90.68 -2.41 57.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.196 178.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.445 ' O ' ' HG ' ' A' ' 96' ' ' LEU . 0.9 OUTLIER -77.82 -42.58 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.229 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.64 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -55.95 -27.95 54.76 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.13 178.842 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.64 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 16.9 t60 -62.39 -64.15 1.01 Allowed 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.25 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -63.35 -9.86 13.99 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.127 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 32.7 mt -89.25 -63.37 1.3 Allowed 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.905 0.384 . . . . 0.0 110.317 179.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -63.36 -13.95 44.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.011 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -85.16 -28.7 25.32 Favored 'General case' 0 N--CA 1.458 -0.05 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.553 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.428 HD13 ' HB2' ' A' ' 5' ' ' LEU . 18.8 tp -62.66 -53.93 47.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.845 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 38.9 t -71.68 -27.84 29.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.36 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -94.83 33.57 1.46 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.142 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.911 179.851 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.796 0.331 . . . . 0.0 111.224 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -77.83 118.72 20.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.769 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 174.36 -31.45 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.805 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -59.13 -17.32 25.73 Favored 'General case' 0 CA--C 1.514 -0.412 0 O-C-N 122.825 -0.221 . . . . 0.0 111.136 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.46 -24.73 3.31 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 22.4 p-10 -57.95 -41.3 82.57 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.68 178.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -50.26 -30.99 12.99 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.179 0.514 . . . . 0.0 109.88 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -84.96 -30.46 24.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.091 179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 15.5 mt -63.56 -34.36 77.64 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.563 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.77 -42.18 67.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.269 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.43 -46.81 69.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.945 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.542 ' HG ' ' N ' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -58.31 -60.48 3.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.677 179.995 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.542 ' N ' ' HG ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -52.59 -36.44 56.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.082 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -77.1 -29.91 55.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.249 -0.432 . . . . 0.0 109.901 179.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.497 ' CG2' ' HA ' ' A' ' 85' ' ' ILE . 0.5 OUTLIER -64.09 -26.86 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.855 178.871 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.509 ' O ' HD21 ' A' ' 19' ' ' LEU . 2.5 mm? -63.35 -35.91 81.96 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.694 178.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -42.98 -35.06 1.11 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.244 0.545 . . . . 0.0 110.076 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -78.38 -49.92 12.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.064 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.539 HD23 ' CD2' ' A' ' 20' ' ' HIS . 0.0 OUTLIER -47.37 -43.64 23.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.468 -179.885 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.539 ' CD2' HD23 ' A' ' 19' ' ' LEU . 30.1 m170 -49.49 -36.5 23.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.913 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.429 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 4.2 mmpt? -90.21 4.66 49.92 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.426 ' ND2' ' HA3' ' A' ' 78' ' ' GLY . 9.8 m120 -148.61 18.59 1.03 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.998 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.668 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -88.05 -52.7 5.11 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.39 179.316 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.539 ' N ' ' CG ' ' A' ' 23' ' ' TRP . 10.6 t-160 179.94 52.1 0.0 OUTLIER 'General case' 0 C--O 1.232 0.153 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.223 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 70.63 120.62 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.255 0 N-CA-C 115.205 0.842 . . . . 0.0 115.205 177.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.78 130.02 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 115.207 -0.496 . . . . 0.0 114.321 177.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.447 ' HG3' ' CD2' ' A' ' 20' ' ' HIS . 3.5 ttpt -68.05 -14.85 63.29 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.398 -0.401 . . . . 0.0 110.023 178.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -46.79 -47.64 20.85 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.47 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -75.68 -46.98 28.21 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.801 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.668 ' HB2' ' CD1' ' A' ' 23' ' ' TRP . 0.3 OUTLIER -58.47 -28.02 64.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.004 0.43 . . . . 0.0 109.993 179.223 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.442 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 1.2 t60 -45.66 -48.76 14.87 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.451 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.09 -31.14 71.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.246 0.546 . . . . 0.0 110.142 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.52 HG13 ' HA ' ' A' ' 67' ' ' VAL . 2.4 t -72.32 -62.43 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.742 179.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.53 -21.57 64.37 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.307 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.442 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 0.6 OUTLIER -60.13 -41.18 92.14 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 177.312 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.419 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.3 OUTLIER -64.69 -49.74 69.76 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 177.205 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.482 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -51.92 -67.15 0.27 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.763 178.505 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.28 -42.88 10.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.812 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.9 m-20 -58.25 -30.32 66.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.031 179.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.442 ' N ' ' O ' ' A' ' 37' ' ' LEU . 21.7 t -65.19 -50.31 74.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.162 179.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 12.5 mm -44.24 -41.15 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.758 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.612 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 0.5 OUTLIER -72.65 -29.89 63.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.703 0.287 . . . . 0.0 111.018 -179.743 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.546 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.3 OUTLIER -84.32 -26.39 28.53 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 178.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 40' ' ' VAL . 6.4 mm -87.3 -50.57 13.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.353 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.612 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -67.21 -26.95 66.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.353 -179.597 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.524 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 9.9 t0 -86.48 -40.87 14.87 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 121.039 0.447 . . . . 0.0 110.054 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.546 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.4 m-85 -73.72 -25.41 60.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.442 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.449 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -50.62 -39.11 49.39 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.001 0.429 . . . . 0.0 110.83 179.466 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -67.04 -25.29 66.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.757 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 130.12 -3.41 5.95 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.894 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.91 -36.32 26.68 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.141 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.411 ' HA3' ' CD2' ' A' ' 47' ' ' PHE . . . -162.56 25.13 0.22 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 121.054 -0.594 . . . . 0.0 112.178 179.597 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.89 -175.87 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.899 0.38 . . . . 0.0 110.98 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 50.02 59.7 7.27 Favored Glycine 0 CA--C 1.517 0.217 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.66 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 147.9 -19.76 1.43 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.624 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.446 ' O ' ' CB ' ' A' ' 60' ' ' MET . 3.6 pptp? -88.18 -41.28 13.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.778 0.323 . . . . 0.0 111.023 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.52 ' O ' ' CB ' ' A' ' 61' ' ' MET . 14.1 tp -65.55 -9.72 28.86 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.884 -179.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -86.3 -49.41 7.7 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.826 179.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -87.31 -31.17 20.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.439 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.446 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 1.3 tpt -77.54 -30.82 52.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.845 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.52 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -56.24 -43.0 78.22 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.265 179.678 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.79 -20.18 63.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.02 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -74.29 -29.42 61.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.464 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.469 ' CE2' ' HG2' ' A' ' 61' ' ' MET . 1.4 p90 -87.08 -28.97 22.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.962 0.411 . . . . 0.0 110.682 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.46 ' CG ' ' CE1' ' A' ' 64' ' ' PHE . 4.1 mt-30 -81.23 -34.14 32.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.92 179.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 9.0 tm0? -56.58 -35.13 67.85 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.855 0.36 . . . . 0.0 110.787 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.52 ' HA ' HG13 ' A' ' 33' ' ' VAL . 9.5 t -55.62 -49.11 76.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.327 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.53 ' HG ' HD23 ' A' ' 71' ' ' LEU . 1.2 mp -65.1 -10.85 33.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.738 179.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -69.54 -59.86 2.7 Favored 'General case' 0 N--CA 1.458 -0.068 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.483 ' CG ' ' CZ3' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -48.91 -40.91 31.83 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 122.232 1.015 . . . . 0.0 109.198 177.769 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.537 HD12 ' HG ' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -69.99 -67.78 0.46 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 113.313 -1.767 . . . . 0.0 112.207 -179.279 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -49.24 -30.0 6.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.033 -179.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -87.4 9.4 20.79 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.628 0.232 . . . . 0.0 111.628 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.507 ' O ' ' N ' ' A' ' 76' ' ' GLN . 85.4 m-70 -151.98 27.89 0.61 Allowed 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.486 ' CD1' HG23 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -51.38 89.34 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 178.32 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.507 ' N ' ' O ' ' A' ' 74' ' ' HIS . 3.9 mm-40 -66.36 68.09 0.06 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.19 -178.352 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.36 46.56 86.72 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.66 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.426 ' HA3' ' ND2' ' A' ' 22' ' ' ASN . . . -152.21 39.39 0.76 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.502 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.477 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -46.89 -39.73 12.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.716 0.293 . . . . 0.0 111.332 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 31.7 t60 -47.99 -33.57 8.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.55 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.55 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.3 m -67.97 -73.53 0.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.262 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 86' ' ' GLU . 25.3 t -50.15 -40.31 17.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.037 179.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.49 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 10.3 t60 -48.91 -41.14 32.61 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -76.61 -28.87 56.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.801 178.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.55 HG22 ' O ' ' A' ' 81' ' ' THR . 0.2 OUTLIER -85.28 -31.16 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.137 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.012 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -76.01 -48.41 21.13 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.568 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.77 -30.06 60.64 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 177.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -83.08 -59.52 2.45 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.676 179.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.51 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -60.96 -50.32 81.05 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.882 -179.323 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 1.3 mptp? -61.43 -29.09 69.72 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.878 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -90.69 0.13 57.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.982 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.514 ' O ' ' HG ' ' A' ' 96' ' ' LEU . 0.8 OUTLIER -78.67 -45.01 25.66 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.031 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.637 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -53.05 -26.35 15.59 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.081 178.419 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.637 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.7 OUTLIER -60.29 -64.22 1.03 Allowed 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.296 -179.365 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.8 m-70 -66.02 -9.52 31.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.351 178.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 34.9 mt -89.17 -58.16 2.64 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 120.944 0.402 . . . . 0.0 110.442 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.68 -10.93 60.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.061 178.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -90.7 -12.99 35.01 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.969 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.449 ' CD2' ' HG3' ' A' ' 48' ' ' MET . 4.5 tp -87.11 -56.58 3.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.002 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 45.9 t -62.98 -46.03 97.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.273 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -60.04 -30.03 68.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.011 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.145 -0.931 . . . . 0.0 110.857 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mtt . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 120.787 0.327 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.464 ' HD2' HD13 ' A' ' 99' ' ' LEU . 2.6 m-85 -96.52 90.59 5.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.837 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -131.73 3.82 5.38 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.734 -0.746 . . . . 0.0 113.068 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -82.31 -21.63 36.0 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 116.856 0.328 . . . . 0.0 110.971 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.456 ' CD2' HD12 ' A' ' 99' ' ' LEU . 0.2 OUTLIER -51.26 -21.98 2.46 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.371 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.432 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 8.5 t30 -62.46 -40.41 96.54 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.789 178.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -50.44 -30.12 11.83 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.226 0.536 . . . . 0.0 109.745 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -85.67 -27.71 25.19 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.953 178.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 13.4 mt -70.83 -13.06 61.9 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.092 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -75.4 -42.21 54.27 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.805 0.336 . . . . 0.0 111.322 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -56.53 -48.17 77.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.186 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.477 ' CB ' HG12 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -54.78 -58.84 5.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.632 -179.874 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.475 ' N ' ' HG ' ' A' ' 12' ' ' LEU . 1.4 tt0 -52.38 -35.54 51.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.955 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.87 -28.18 49.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.973 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.457 HG11 ' HB ' ' A' ' 85' ' ' ILE . 0.5 OUTLIER -67.64 -26.8 36.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.196 179.286 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.468 HD11 HD11 ' A' ' 19' ' ' LEU . 2.4 mm? -62.85 -36.15 82.28 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.247 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.414 ' HA ' ' CE ' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -46.66 -40.27 12.85 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.047 0.451 . . . . 0.0 109.933 179.397 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.46 ' O ' HG21 ' A' ' 81' ' ' THR . 0.6 OUTLIER -68.21 -41.01 81.94 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.241 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.532 ' HG ' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -57.22 -38.37 73.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.737 179.534 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.523 ' HA ' ' HG ' ' A' ' 30' ' ' LEU . 39.8 m-70 -51.68 -34.84 40.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.853 0.359 . . . . 0.0 111.144 179.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.509 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.7 mmpt? -94.15 2.36 55.97 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -178.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -139.54 5.75 2.24 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -179.548 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.563 ' CD1' ' CD2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -80.47 -37.11 32.47 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.109 179.41 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.467 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 86.0 t60 -176.75 -49.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.736 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 146.86 132.38 2.31 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.102 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 80.48 101.25 0.31 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.522 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.84 -25.45 7.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.753 0.311 . . . . 0.0 110.451 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.81 -31.48 49.28 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.432 179.475 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -85.25 -42.88 14.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.343 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.563 ' CD2' ' CD1' ' A' ' 23' ' ' TRP . 1.2 tm? -62.76 -34.72 77.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.923 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.444 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 33.7 t-80 -47.74 -39.49 17.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.214 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -76.59 -21.89 54.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.676 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.538 HG13 ' O ' ' A' ' 30' ' ' LEU . 1.6 p -91.66 -46.73 14.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.716 -0.22 . . . . 0.0 111.254 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.501 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 2.7 t70 -72.97 -27.16 61.65 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.264 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.444 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 1.1 t30 -53.94 -32.68 54.48 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 178.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -63.73 -34.36 77.69 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.287 178.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.413 HD21 ' HB2' ' A' ' 64' ' ' PHE . 0.1 OUTLIER -71.3 -66.3 0.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.195 179.202 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -47.37 -35.69 8.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.015 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -70.16 -31.71 69.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.229 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.45 ' O ' HG13 ' A' ' 44' ' ' ILE . 49.5 t -71.49 -36.9 62.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.213 179.257 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 35.2 mm -49.79 -35.42 10.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.851 179.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.569 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -75.64 -25.39 56.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.202 179.326 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 3.3 m-20 -82.19 -27.24 32.73 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.621 178.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 40' ' ' VAL . 0.1 OUTLIER -87.08 -52.71 11.33 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.121 179.321 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.569 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -62.13 -27.31 68.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.707 0.289 . . . . 0.0 110.701 -179.733 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.51 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 11.7 t0 -86.83 -32.55 20.23 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.087 0.47 . . . . 0.0 110.161 179.446 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.568 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.3 m-85 -81.6 -45.87 15.21 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.703 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 11.5 ptp -50.23 -24.4 2.84 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.446 -179.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -89.92 13.14 15.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.628 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 104.73 25.94 6.65 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.787 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -102.14 27.01 22.28 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.561 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 101.78 27.34 7.13 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.543 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.89 -15.73 62.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.659 0.266 . . . . 0.0 111.35 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.82 73.26 2.59 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.61 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 131.92 -12.43 5.33 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.635 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.417 ' O ' ' CB ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.39 -28.14 21.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.612 0.244 . . . . 0.0 110.956 -179.881 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.51 ' O ' ' CB ' ' A' ' 61' ' ' MET . 0.4 OUTLIER -70.16 -9.2 54.92 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 121.021 -0.272 . . . . 0.0 111.722 -179.679 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.402 ' CG ' ' N ' ' A' ' 59' ' ' GLU . 15.1 pt20 -86.77 -50.81 6.48 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.615 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.402 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 0.4 OUTLIER -86.22 -31.74 21.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.802 -179.726 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.417 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -78.39 -30.8 48.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.098 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.51 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -59.37 -41.75 90.05 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.316 179.708 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -60.78 -19.47 59.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.576 179.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -74.26 -31.35 62.52 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.508 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.453 ' CE2' ' HG2' ' A' ' 61' ' ' MET . 1.0 OUTLIER -87.41 -26.37 23.33 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.01 0.433 . . . . 0.0 109.891 179.608 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -82.51 -32.2 28.83 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.877 178.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -59.03 -33.62 70.95 Favored 'General case' 0 C--O 1.23 0.063 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.488 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.458 HG12 HG12 ' A' ' 33' ' ' VAL . 87.9 t -54.96 -38.35 45.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.178 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.547 ' HA ' HD23 ' A' ' 71' ' ' LEU . 1.8 mp -74.98 -7.55 53.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.513 178.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -74.31 -59.45 2.72 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.434 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 6.8 tp10 -51.67 -34.48 38.48 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 122.029 0.919 . . . . 0.0 108.786 177.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.555 HD11 ' CB ' ' A' ' 23' ' ' TRP . 0.3 OUTLIER -72.53 -65.78 0.74 Allowed 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 113.613 -1.631 . . . . 0.0 111.806 -179.418 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.434 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 15.1 t-20 -51.18 -24.27 4.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.851 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -85.14 2.78 42.08 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -179.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.578 ' O ' ' N ' ' A' ' 76' ' ' GLN . 2.4 m-70 -151.53 36.34 0.57 Allowed 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.677 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.555 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -52.08 86.55 0.0 OUTLIER 'General case' 0 C--O 1.231 0.119 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.733 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.578 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -79.16 -39.17 34.14 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.485 -177.399 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -101.1 25.15 29.36 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 120.505 -0.855 . . . . 0.0 114.077 -178.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 88.8 127.32 2.9 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.855 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.555 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -50.46 -19.97 1.01 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.606 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -40.86 -38.16 0.9 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.749 0.309 . . . . 0.0 111.615 -179.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.46 HG21 ' O ' ' A' ' 18' ' ' ASN . 1.3 m -69.48 -73.34 0.16 Allowed 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 178.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.58 ' HA ' HG12 ' A' ' 85' ' ' ILE . 41.8 t -47.39 -37.02 4.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.975 179.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.516 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -50.52 -41.46 53.75 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.1 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -76.43 -27.9 56.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.537 178.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.58 HG12 ' HA ' ' A' ' 82' ' ' VAL . 0.2 OUTLIER -84.07 -33.98 9.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.731 179.972 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.582 ' O ' ' HB2' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -74.31 -51.7 14.43 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 178.939 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.412 ' HA ' ' NE2' ' A' ' 87' ' ' GLN . 3.0 mm-40 -54.16 -28.19 38.61 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.245 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.664 ' O ' HD11 ' A' ' 92' ' ' ILE . 2.2 m-80 -83.01 -67.12 0.81 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.08 178.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.516 ' O ' ' HB ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -50.46 -33.45 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.528 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.582 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 0.9 OUTLIER -67.75 -24.82 65.39 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.717 -0.793 . . . . 0.0 109.609 179.798 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -86.88 -4.95 59.23 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.075 178.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.664 HD11 ' O ' ' A' ' 88' ' ' ASN . 1.7 mp -78.47 -57.86 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 179.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.489 ' CD1' ' C ' ' A' ' 93' ' ' PHE . 0.2 OUTLIER -46.12 -44.79 16.0 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.561 178.958 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.48 ' N ' ' CG ' ' A' ' 93' ' ' PHE . 1.1 t60 -57.92 -61.4 2.56 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.958 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -61.44 -12.19 13.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.526 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.659 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 20.3 mt -89.25 -65.47 1.01 Allowed 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.927 0.394 . . . . 0.0 110.494 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -64.12 -14.07 52.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.201 179.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.432 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 3.5 tp10 -86.7 -24.98 25.01 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.559 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.464 HD13 ' HD2' ' A' ' 2' ' ' TYR . 7.5 tp -70.46 -57.14 5.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.626 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.3 t -60.09 -28.47 41.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.18 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -96.08 32.99 1.8 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.136 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.862 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.6 mtt . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.776 0.322 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.496 ' HB3' ' HB3' ' A' ' 99' ' ' LEU . 9.3 m-85 -103.81 66.76 0.86 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.865 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -123.2 -21.63 2.5 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.708 -0.758 . . . . 0.0 113.007 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.407 ' CE ' ' HA ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -60.44 -18.83 53.63 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 116.807 0.303 . . . . 0.0 111.38 -179.727 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.482 ' CD2' HD23 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -52.84 -20.99 3.69 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.352 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.407 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 24.4 p-10 -54.3 -44.71 72.21 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.362 178.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -53.83 -29.43 40.92 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.401 ' HB3' HD11 ' A' ' 5' ' ' LEU . 1.5 tm? -87.41 -28.61 22.04 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.782 178.649 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.433 ' O ' ' CD2' ' A' ' 12' ' ' LEU . 10.7 mt -60.11 -35.67 75.76 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 121.179 0.514 . . . . 0.0 109.85 179.372 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -55.37 -37.7 67.87 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.153 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.2 -53.01 39.07 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.965 0.412 . . . . 0.0 110.725 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.534 ' HG ' ' N ' ' A' ' 13' ' ' GLN . 0.0 OUTLIER -54.78 -57.1 12.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.322 179.55 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.534 ' N ' ' HG ' ' A' ' 12' ' ' LEU . 31.0 tt0 -52.18 -36.48 51.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.795 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.57 -30.66 57.13 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.479 ' CG2' ' HA ' ' A' ' 85' ' ' ILE . 0.5 OUTLIER -62.81 -26.23 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.828 178.753 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.484 HD22 ' HA ' ' A' ' 13' ' ' GLN . 3.2 mm? -65.52 -32.77 74.55 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.539 178.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.447 ' HA ' ' HD1' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -44.18 -37.11 2.96 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.232 0.539 . . . . 0.0 110.146 179.131 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -77.4 -49.21 15.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.986 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.575 ' HG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -43.22 -49.33 6.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.818 -179.88 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.526 ' CD2' HD11 ' A' ' 30' ' ' LEU . 41.0 m80 -48.21 -40.54 24.66 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -179.244 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.449 ' HE3' ' HB2' ' A' ' 20' ' ' HIS . 2.8 mmpt? -87.25 7.61 27.73 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -177.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.415 ' ND2' ' OG1' ' A' ' 81' ' ' THR . 70.0 m-80 -153.93 19.25 0.51 Allowed 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.315 -0.554 . . . . 0.0 112.195 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.643 ' CZ3' ' HG3' ' A' ' 70' ' ' GLU . 0.5 OUTLIER -87.05 -33.7 19.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.986 0.422 . . . . 0.0 110.08 178.972 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.489 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 3.7 t60 -177.15 -51.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.579 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 160.26 130.26 1.11 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.464 -0.874 . . . . 0.0 113.12 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.68 120.39 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.74 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.412 ' HD2' ' CG ' ' A' ' 20' ' ' HIS . 18.8 tttt -62.22 -18.64 61.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.651 0.262 . . . . 0.0 110.771 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -50.25 -41.01 49.51 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.98 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -77.86 -49.49 14.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.491 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.641 ' HB2' ' CD1' ' A' ' 23' ' ' TRP . 1.4 tm? -56.42 -30.23 62.55 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.449 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.3 OUTLIER -45.79 -43.96 13.63 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.995 179.993 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.64 -26.23 64.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.081 0.467 . . . . 0.0 110.54 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.469 HG13 HD12 ' A' ' 30' ' ' LEU . 2.3 t -83.5 -62.29 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.888 179.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.46 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 0.6 OUTLIER -58.5 -23.05 57.03 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.333 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.449 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 0.7 OUTLIER -59.73 -41.08 90.11 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 177.77 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.422 ' HB2' ' O ' ' A' ' 33' ' ' VAL . 0.8 OUTLIER -62.69 -49.48 74.94 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 177.485 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.481 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 0.1 OUTLIER -56.15 -68.71 0.18 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.571 178.358 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -47.13 -43.86 21.07 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.27 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -61.24 -27.99 68.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.551 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.411 ' O ' HG13 ' A' ' 44' ' ' ILE . 68.0 t -76.0 -41.48 38.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.557 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.416 ' CD1' HD23 ' A' ' 12' ' ' LEU . 25.9 mm -47.91 -36.8 5.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.164 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.576 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -71.8 -29.1 64.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.433 179.646 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.562 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 13.7 m-20 -84.19 -27.27 28.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.931 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.531 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 1.8 mt -86.85 -52.77 11.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.188 179.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.576 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -62.7 -28.12 69.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.237 -179.782 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.52 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 39.0 t0 -86.77 -38.68 16.66 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 120.961 0.41 . . . . 0.0 110.316 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.562 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.2 m-85 -77.68 -24.01 49.41 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.711 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.474 ' HB2' ' O ' ' A' ' 44' ' ' ILE . 0.8 OUTLIER -52.41 -36.98 55.56 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 121.093 0.473 . . . . 0.0 110.502 179.482 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -71.67 -11.22 60.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.124 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 118.62 20.78 4.13 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.752 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -86.37 27.56 5.64 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.44 -0.886 . . . . 0.0 111.954 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 115.7 27.39 3.05 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.121 -0.561 . . . . 0.0 112.12 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.4 t -85.76 36.51 0.66 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.753 0.311 . . . . 0.0 111.611 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -107.1 -32.89 3.36 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.586 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.407 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . -135.62 7.95 4.26 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.986 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.531 ' HE3' ' HA ' ' A' ' 44' ' ' ILE . 0.0 OUTLIER -88.6 -41.14 12.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.983 0.42 . . . . 0.0 111.375 179.959 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.497 ' O ' ' CB ' ' A' ' 61' ' ' MET . 49.8 tp -60.26 -11.68 7.01 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.817 -0.628 . . . . 0.0 112.289 -178.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 1.7 pp0? -86.24 -50.31 7.06 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.657 -0.417 . . . . 0.0 111.202 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.97 -32.23 20.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.827 0.346 . . . . 0.0 110.454 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.476 ' HG2' ' NZ ' ' A' ' 56' ' ' LYS . 29.9 tpp -75.73 -29.78 59.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.473 179.564 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.497 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 3.0 ttt -52.58 -40.74 62.93 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.905 0.383 . . . . 0.0 110.312 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.6 tptt -63.07 -24.21 67.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.857 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -70.28 -30.88 68.02 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.385 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.482 ' CE2' ' HG3' ' A' ' 61' ' ' MET . 0.8 OUTLIER -86.96 -30.04 21.59 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.085 0.469 . . . . 0.0 110.228 179.866 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -82.4 -31.62 29.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.568 179.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -59.36 -37.16 77.18 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.786 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.481 ' CG2' ' HB2' ' A' ' 37' ' ' LEU . 3.9 t -53.39 -42.75 49.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.434 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.519 ' HG ' HD22 ' A' ' 71' ' ' LEU . 0.8 OUTLIER -70.76 -7.09 42.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.858 179.306 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -73.37 -55.96 5.69 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.643 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 2.6 tp10 -53.69 -38.01 63.8 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 122.018 0.913 . . . . 0.0 108.885 177.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.575 HD13 ' HG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -75.05 -70.82 0.39 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 113.686 -1.597 . . . . 0.0 112.283 -178.928 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.409 ' OD1' ' N ' ' A' ' 73' ' ' ASN . 8.0 p-10 -49.32 -27.38 3.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.608 -179.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.409 ' N ' ' OD1' ' A' ' 72' ' ' ASN . 2.9 t-20 -91.69 13.65 17.48 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.271 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.467 ' O ' ' N ' ' A' ' 76' ' ' GLN . 63.0 m-70 -151.96 24.31 0.66 Allowed 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.441 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.4 OUTLIER -47.63 94.74 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.887 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.467 ' N ' ' O ' ' A' ' 74' ' ' HIS . 9.9 tp60 -59.39 -61.61 2.5 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.34 -177.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.4 31.78 0.44 Allowed Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.235 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -141.15 49.36 0.78 Allowed Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.804 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.441 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -48.63 -27.52 2.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.716 0.293 . . . . 0.0 110.882 179.623 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -67.5 -26.92 66.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.954 179.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.602 ' O ' HG21 ' A' ' 85' ' ' ILE . 1.2 m -68.04 -75.1 0.11 Allowed 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 179.274 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.565 ' O ' ' N ' ' A' ' 86' ' ' GLU . 21.3 t -48.3 -42.95 11.84 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.765 179.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.501 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 1.8 t60 -47.93 -42.05 26.29 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.226 0.536 . . . . 0.0 109.797 179.235 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.3 m80 -76.44 -28.42 56.58 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.675 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.602 HG21 ' O ' ' A' ' 81' ' ' THR . 0.1 OUTLIER -85.48 -29.99 6.46 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.178 -179.616 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -76.75 -46.82 23.78 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 178.869 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -60.67 -27.91 68.2 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.4 ' O ' ' CD1' ' A' ' 92' ' ' ILE . 1.7 m-80 -83.05 -58.31 2.91 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.263 178.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.525 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -62.17 -47.99 90.55 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.287 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.32 -179.739 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -61.69 -28.37 69.35 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.042 -0.663 . . . . 0.0 109.724 179.735 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -90.56 -1.26 57.88 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.09 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.468 ' O ' ' HG ' ' A' ' 96' ' ' LEU . 0.9 OUTLIER -78.64 -44.09 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.287 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.638 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -55.06 -27.0 41.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.137 178.585 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.638 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 2.6 t-160 -62.75 -59.8 4.38 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.853 -179.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.434 ' O ' ' HG2' ' A' ' 98' ' ' GLU . 38.9 m170 -67.3 -11.03 56.53 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.189 178.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 36.6 mt -90.0 -56.97 3.02 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.004 0.431 . . . . 0.0 110.818 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -65.23 -10.63 33.46 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.472 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 95' ' ' HIS . 14.2 pt-20 -81.97 -28.07 32.87 Favored 'General case' 0 N--CA 1.461 0.091 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.508 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.496 ' HB3' ' HB3' ' A' ' 2' ' ' TYR . 1.7 mt -69.43 -64.05 0.95 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.183 0.516 . . . . 0.0 110.639 179.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.77 -26.58 35.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.012 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -85.39 -35.15 21.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.775 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.406 ' O ' ' CZ ' ' A' ' 2' ' ' TYR . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.141 -0.933 . . . . 0.0 110.873 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.899 0.38 . . . . 0.0 111.185 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' TYR . . . . . 0.402 ' N ' ' CD1' ' A' ' 2' ' ' TYR . 2.3 m-85 -101.09 76.88 1.77 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.841 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -130.11 3.59 5.96 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.892 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.8 tpmt? -84.12 -17.73 39.14 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 116.765 0.282 . . . . 0.0 110.649 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.44 ' HB2' HD12 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -53.79 -20.63 5.96 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 177.985 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.412 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 35.5 p-10 -61.2 -42.6 98.87 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.677 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -49.43 -29.47 6.54 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.17 0.509 . . . . 0.0 109.802 179.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.42 ' CD1' ' O ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -84.39 -34.46 23.57 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.067 179.038 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.8 mt -64.07 -29.56 70.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.082 0.468 . . . . 0.0 110.598 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.63 -49.94 64.14 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.337 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -54.52 -46.07 73.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.881 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.601 ' HA ' HG13 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -54.53 -61.0 2.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.491 179.747 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.466 ' HA ' HD22 ' A' ' 16' ' ' LEU . 4.9 tt0 -52.76 -37.42 59.42 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.617 -179.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.41 -30.26 53.47 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.035 0.445 . . . . 0.0 110.052 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.601 HG13 ' HA ' ' A' ' 12' ' ' LEU . 0.9 OUTLIER -64.96 -27.48 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.104 178.984 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.531 HD12 HD12 ' A' ' 85' ' ' ILE . 2.6 mm? -61.63 -39.69 92.19 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 178.291 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.3 ttpt -39.14 -39.55 0.6 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.005 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.481 ' C ' HG23 ' A' ' 81' ' ' THR . 7.4 m-20 -66.01 -55.68 15.47 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.419 -0.809 . . . . 0.0 108.982 178.018 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.584 ' HB2' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -39.47 -47.57 1.86 Allowed 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 114.561 -1.2 . . . . 0.0 111.969 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.563 ' CB ' ' HE3' ' A' ' 21' ' ' LYS . 42.6 m-70 -50.64 -37.03 38.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.563 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.6 mmpt? -94.23 8.37 42.0 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -177.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.454 ' HB2' ' CG2' ' A' ' 81' ' ' THR . 35.0 m120 -152.69 10.14 0.48 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.143 -0.623 . . . . 0.0 112.57 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.568 ' CD1' ' CD2' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -75.16 -34.71 61.62 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.846 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.479 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 81.7 t60 -178.41 -50.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.672 178.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -130.88 -91.68 0.57 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.027 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -136.11 -142.52 4.51 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.888 -0.672 . . . . 0.0 111.785 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.8 tttm -93.62 -18.53 22.08 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.612 0.244 . . . . 0.0 111.125 179.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -54.66 -56.31 20.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.804 0.335 . . . . 0.0 110.928 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -79.96 -17.41 53.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.021 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.568 ' CD2' ' CD1' ' A' ' 23' ' ' TRP . 1.2 tm? -80.9 -31.74 35.06 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.038 0.447 . . . . 0.0 109.936 179.455 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -51.47 -36.91 46.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.116 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -76.57 -25.22 53.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.505 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.492 HG13 ' O ' ' A' ' 30' ' ' LEU . 1.5 p -90.35 -42.71 14.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.062 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.498 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 1.2 t0 -73.13 -31.77 64.5 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 179.11 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -51.97 -29.55 21.08 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -72.69 -36.41 67.87 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.344 -0.844 . . . . 0.0 109.408 178.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.439 ' HA ' HG21 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -68.45 -66.81 0.52 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.38 179.267 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -45.39 -36.0 3.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.307 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -65.99 -31.07 71.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.943 0.402 . . . . 0.0 110.39 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.576 ' O ' HG12 ' A' ' 44' ' ' ILE . 32.6 t -64.55 -53.86 37.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.8 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.485 ' CG2' ' CE1' ' A' ' 45' ' ' HIS . 38.3 mm -38.1 -42.35 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.935 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -71.7 -39.68 70.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.793 0.33 . . . . 0.0 110.405 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.484 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.7 OUTLIER -71.72 -28.64 63.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.549 179.399 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.576 HG12 ' O ' ' A' ' 40' ' ' VAL . 7.1 mm -86.83 -40.53 14.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.867 0.365 . . . . 0.0 110.686 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.485 ' CE1' ' CG2' ' A' ' 41' ' ' ILE . 13.7 m170 -73.87 -39.01 64.26 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.345 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -74.38 -26.09 59.89 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.484 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.6 m-85 -88.61 -46.19 9.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.979 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.415 ' HE3' ' N ' ' A' ' 5' ' ' LEU . 8.4 ptm -46.49 -32.38 3.29 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.84 0.352 . . . . 0.0 111.406 -179.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -26.57 66.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.244 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 146.52 -13.75 1.59 Allowed Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.599 -0.81 . . . . 0.0 113.009 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.73 -42.65 37.13 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.86 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 168.69 39.2 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.607 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 7.8 p -59.35 -24.38 63.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.735 0.302 . . . . 0.0 111.032 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.95 57.93 4.02 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.298 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 171.14 -28.1 0.11 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.937 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.449 ' HE3' ' CD1' ' A' ' 44' ' ' ILE . 0.6 OUTLIER -87.94 -30.04 20.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.921 0.361 . . . . 0.0 110.974 -179.866 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.503 ' O ' ' CB ' ' A' ' 61' ' ' MET . 12.8 tp -61.53 -10.92 8.97 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.046 -0.261 . . . . 0.0 111.602 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.421 ' CG ' ' N ' ' A' ' 59' ' ' GLU . 13.4 pt20 -85.75 -49.86 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.751 -0.38 . . . . 0.0 110.798 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.421 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 19.7 mm-40 -87.42 -33.8 18.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.133 0.492 . . . . 0.0 110.295 179.342 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.421 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 3.5 tpt -74.6 -27.19 60.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.834 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.503 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 3.9 ttp -58.48 -47.61 83.49 Favored 'General case' 0 C--O 1.231 0.086 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.013 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -62.28 -24.51 67.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.512 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -67.8 -32.29 72.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.318 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.49 ' CD1' ' C ' ' A' ' 64' ' ' PHE . 0.9 OUTLIER -86.99 -33.47 19.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.888 0.375 . . . . 0.0 110.511 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.404 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 10.2 tt0 -80.76 -32.8 35.41 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.997 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.66 -33.09 71.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.768 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.427 HG23 ' HB2' ' A' ' 37' ' ' LEU . 95.1 t -58.46 -44.32 88.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.57 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.521 ' HA ' ' HB3' ' A' ' 71' ' ' LEU . 1.3 mp -73.21 -6.37 45.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.78 179.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -73.1 -54.37 8.68 Favored 'General case' 0 N--CA 1.457 -0.122 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.499 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 5.3 tp10 -57.95 -31.72 67.12 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.881 0.848 . . . . 0.0 108.967 177.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.584 HD11 ' HB2' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -76.98 -72.04 0.37 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.905 -1.498 . . . . 0.0 112.378 -178.8 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -51.45 -26.13 7.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.46 -179.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -86.45 8.15 22.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.166 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.527 ' O ' ' N ' ' A' ' 76' ' ' GLN . 36.5 m-70 -146.41 29.46 1.05 Allowed 'General case' 0 CA--C 1.523 -0.094 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.51 HD22 ' HB ' ' A' ' 82' ' ' VAL . 0.3 OUTLIER -49.93 88.9 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.236 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 74' ' ' HIS . 1.4 tm0? -62.37 -48.75 78.38 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.94 0.4 . . . . 0.0 110.76 -178.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -172.54 34.91 0.13 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.334 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.43 ' HA3' ' ND2' ' A' ' 22' ' ' ASN . . . -142.55 49.77 0.73 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.659 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.456 ' HD2' ' N ' ' A' ' 79' ' ' LYS . 0.0 OUTLIER -45.5 -36.26 4.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.618 0.246 . . . . 0.0 111.246 179.952 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 36.0 m80 -59.72 -40.78 89.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.605 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.512 ' O ' HG21 ' A' ' 85' ' ' ILE . 1.4 m -59.28 -64.47 0.93 Allowed 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.939 179.118 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.809 ' HA ' ' CG2' ' A' ' 85' ' ' ILE . 9.5 t -60.05 -49.29 84.6 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.093 -179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.521 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 1.4 m-70 -50.77 -40.23 54.48 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.946 -0.301 . . . . 0.0 110.773 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 -75.41 -56.4 4.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.909 0.385 . . . . 0.0 110.28 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.809 ' CG2' ' HA ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -58.33 -32.98 46.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.751 179.477 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.576 ' CG ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -81.16 -39.87 24.85 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.638 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.521 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 1.1 mp0 -66.79 -25.94 66.71 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 177.12 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.415 ' O ' ' CD1' ' A' ' 92' ' ' ILE . 1.4 m-80 -82.65 -52.96 6.31 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.746 178.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.563 ' HB ' ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -66.18 -50.49 68.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.932 179.843 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.402 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 0.3 OUTLIER -56.96 -27.31 61.07 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 120.43 -0.508 . . . . 0.0 109.991 -179.855 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -90.7 -5.34 55.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.354 178.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.469 ' O ' ' HG ' ' A' ' 96' ' ' LEU . 1.0 OUTLIER -78.6 -46.2 24.97 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 179.38 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.622 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.2 OUTLIER -48.53 -28.92 3.69 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.348 178.976 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.622 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.5 OUTLIER -60.12 -62.99 1.46 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.102 -179.518 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -68.07 -8.72 40.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.345 178.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 23.0 mt -88.52 -56.17 3.42 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.995 0.426 . . . . 0.0 110.009 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.402 ' HA ' ' CD2' ' A' ' 57' ' ' LEU . 0.4 OUTLIER -71.63 -9.81 58.81 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.824 178.486 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -88.16 -30.5 19.74 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.514 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.44 HD12 ' HB2' ' A' ' 5' ' ' LEU . 10.8 tp -67.6 -56.07 10.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.918 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.2 t -62.2 -37.99 79.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.417 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -63.73 -39.22 93.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.938 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.874 179.94 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.449 ' HA2' ' HB3' ' A' ' 48' ' ' MET . . . . . . . . 0 N--CA 1.45 -0.421 0 N-CA-C 112.788 -0.125 . . . . 0.0 112.788 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.0 tptt -62.97 -17.42 62.04 Favored 'General case' 0 CA--C 1.513 -0.455 0 O-C-N 122.809 -0.23 . . . . 0.0 111.327 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 1.089 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -52.88 -23.43 7.07 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.005 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.415 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 39.4 p-10 -61.25 -39.69 91.27 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.851 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -50.13 -29.61 9.48 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.079 0.466 . . . . 0.0 110.185 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.6 ' C ' HD13 ' A' ' 8' ' ' LEU . 1.8 tm? -87.66 -29.35 21.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.281 179.344 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.686 ' HB3' HD11 ' A' ' 41' ' ' ILE . 11.1 mt -67.74 -35.54 78.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.563 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -51.78 -47.8 64.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.664 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -49.16 -46.29 45.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.26 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.907 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -55.46 -58.71 6.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.762 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.527 ' HA ' HD23 ' A' ' 16' ' ' LEU . 40.2 tt0 -55.16 -37.73 67.37 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.336 -179.346 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -76.41 -26.46 55.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.87 0.367 . . . . 0.0 110.175 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.874 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -69.87 -27.28 32.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.345 179.31 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.712 ' CD1' HD13 ' A' ' 19' ' ' LEU . 2.7 mm? -62.63 -40.39 96.83 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.179 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -41.24 -39.74 1.43 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.069 0.462 . . . . 0.0 110.54 179.519 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.668 ' HB3' HG23 ' A' ' 81' ' ' THR . 1.1 m-20 -70.7 -47.04 61.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.528 178.696 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.912 HD21 HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -47.67 -40.81 20.88 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.392 179.806 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 1.091 ' CE1' HD12 ' A' ' 30' ' ' LEU . 63.5 m-70 -52.48 -39.29 61.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.908 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.542 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 3.9 mmpt? -86.88 5.07 38.7 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -177.663 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.528 ' HB2' HG21 ' A' ' 81' ' ' THR . 39.1 m-20 -152.97 19.93 0.58 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.745 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.824 ' CB ' HD12 ' A' ' 71' ' ' LEU . 0.8 OUTLIER -84.84 -31.17 23.95 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.645 179.156 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.504 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 84.6 t60 -178.44 -52.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.541 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.23 -87.0 0.3 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.94 -0.647 . . . . 0.0 111.827 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -136.15 -145.52 5.07 Favored Glycine 0 N--CA 1.442 -0.931 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.605 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.436 ' HD2' ' CE1' ' A' ' 20' ' ' HIS . 1.2 ttpt -94.1 -20.88 19.5 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.603 0.24 . . . . 0.0 111.339 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -52.29 -53.85 38.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.557 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -79.41 -27.21 41.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.317 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.091 HD12 ' CE1' ' A' ' 20' ' ' HIS . 2.1 tm? -75.24 -29.28 60.18 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -49.05 -38.29 23.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.653 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -75.91 -23.57 55.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.715 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.911 ' CG1' HG13 ' A' ' 67' ' ' VAL . 0.9 OUTLIER -87.26 -58.16 3.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.831 179.764 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.62 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -59.32 -24.23 63.14 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.898 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.433 ' O ' ' HB2' ' A' ' 39' ' ' ASN . 1.0 OUTLIER -56.67 -44.3 81.28 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 177.816 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.821 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.8 m-70 -57.82 -49.61 76.08 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 177.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.967 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -57.4 -66.64 0.43 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.591 178.536 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.68 ' O ' HG22 ' A' ' 41' ' ' ILE . 0.3 OUTLIER -46.46 -41.99 14.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.684 -179.59 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 35' ' ' ASN . 2.1 t-20 -68.52 -26.02 65.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.875 0.369 . . . . 0.0 110.615 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 1.059 HG12 HD11 ' A' ' 44' ' ' ILE . 53.8 t -77.32 -37.71 25.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.525 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.686 HD11 ' HB3' ' A' ' 9' ' ' LEU . 4.8 tp -48.17 -37.31 7.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 120.995 0.426 . . . . 0.0 110.664 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -75.67 -41.21 54.47 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.699 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.411 ' HB3' ' HE3' ' A' ' 60' ' ' MET . 4.0 m-20 -60.53 -30.23 69.62 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 1.059 HD11 HG12 ' A' ' 40' ' ' VAL . 4.0 mt -86.54 -41.93 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.886 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 25.8 m170 -62.44 -43.97 97.54 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.273 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -73.89 -11.22 60.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.076 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.48 ' CD1' ' C ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -85.43 -42.03 14.87 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.76 179.781 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.537 ' CE ' HD12 ' A' ' 9' ' ' LEU . 1.6 tpp -45.73 -27.74 0.88 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.925 -179.006 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.86 19.96 10.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.788 0.328 . . . . 0.0 111.763 -179.67 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 75.85 33.16 51.79 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.644 -0.788 . . . . 0.0 113.121 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -95.19 40.24 2.71 Favored Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 109.961 -1.255 . . . . 0.0 109.961 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 123.11 21.29 2.59 Favored Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 114.503 -0.849 . . . . 0.0 111.015 -178.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.439 ' HA ' ' CD1' ' A' ' 47' ' ' PHE . 33.4 p -61.36 166.09 4.17 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.088 0.471 . . . . 0.0 111.433 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.671 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . 51.36 51.38 37.1 Favored Glycine 0 N--CA 1.452 -0.284 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.909 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.402 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . 171.61 -33.83 0.14 Allowed Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.288 -0.958 . . . . 0.0 113.192 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.581 ' HD3' ' N ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -88.41 -26.19 22.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.874 0.337 . . . . 0.0 111.689 -179.491 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.581 ' N ' ' HD3' ' A' ' 56' ' ' LYS . 19.7 tp -70.12 -8.14 47.2 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.575 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 55' ' ' GLY . 17.3 pt20 -86.39 -49.88 7.31 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.924 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.4 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 3.8 mt-10 -86.88 -34.1 19.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.447 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.496 ' HG3' HG13 ' A' ' 40' ' ' VAL . 8.7 tpp -74.22 -29.51 61.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.551 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.508 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 5.9 ttm -56.06 -50.74 70.12 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.978 0.418 . . . . 0.0 110.138 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -59.52 -20.87 58.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.824 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.631 ' HB3' HG21 ' A' ' 40' ' ' VAL . 0.7 OUTLIER -71.83 -33.2 68.28 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.043 179.935 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.474 ' CE2' ' HG3' ' A' ' 61' ' ' MET . 1.1 p90 -84.08 -25.81 29.5 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 120.983 0.42 . . . . 0.0 110.068 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -35.33 27.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.256 178.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.08 -32.44 61.95 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.445 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.967 HG21 ' HB2' ' A' ' 37' ' ' LEU . 96.3 t -58.84 -38.74 74.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.005 179.154 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.996 HD21 HG13 ' A' ' 85' ' ' ILE . 0.7 OUTLIER -78.62 -4.33 48.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.233 178.453 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -76.41 -56.74 4.35 Favored 'General case' 0 CA--C 1.521 -0.14 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.604 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 3.1 tp10 -54.02 -36.62 63.2 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.99 0.9 . . . . 0.0 108.674 177.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.925 HD21 HG13 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -74.73 -69.64 0.45 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 113.553 -1.658 . . . . 0.0 112.168 -179.223 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.41 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 42.2 t-20 -50.16 -26.14 4.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.633 -179.282 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -87.27 7.82 26.86 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.428 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.499 ' O ' ' N ' ' A' ' 76' ' ' GLN . 5.7 m-70 -155.38 34.51 0.37 Allowed 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.582 ' CD2' HG21 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -51.23 90.34 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.105 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.029 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.499 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -65.64 68.3 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.536 -177.965 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 57.45 29.67 60.87 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.646 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.553 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -136.86 46.14 1.04 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.476 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.46 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.7 OUTLIER -52.67 -38.99 61.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.751 0.31 . . . . 0.0 111.224 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -49.58 -32.45 12.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.568 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.668 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -69.03 -74.16 0.13 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.356 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.925 HG13 HD21 ' A' ' 71' ' ' LEU . 22.6 t -49.46 -39.19 13.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.914 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.453 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.3 OUTLIER -49.02 -41.51 34.97 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 179.234 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -76.43 -28.92 56.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.694 178.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.996 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.57 -33.41 7.68 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.346 -179.579 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -74.43 -43.06 57.91 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 179.115 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -62.49 -29.33 70.46 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.716 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.8 m-80 -82.92 -57.05 3.47 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.443 179.154 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.972 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -63.51 -51.15 74.15 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.347 -179.675 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.493 ' N ' HG22 ' A' ' 89' ' ' ILE . 5.8 mmtp -59.15 -27.53 65.73 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.119 -0.632 . . . . 0.0 109.782 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -90.72 -2.22 57.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.146 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.716 HD13 ' O ' ' A' ' 88' ' ' ASN . 0.9 OUTLIER -78.44 -46.62 25.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.339 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.639 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -52.5 -27.56 16.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.41 178.927 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.639 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.2 OUTLIER -65.16 -64.06 0.95 Allowed 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.661 -179.586 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.462 ' O ' HD21 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -61.36 -11.51 10.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.993 178.328 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.589 HD11 HD21 ' A' ' 9' ' ' LEU . 24.7 mt -89.34 -65.39 1.02 Allowed 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 120.949 0.404 . . . . 0.0 110.587 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.451 ' N ' HD21 ' A' ' 57' ' ' LEU . 25.4 tt0 -64.16 -14.24 53.78 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.176 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 11.2 tt0 -83.33 -24.87 31.94 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.524 179.488 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 1.089 HD13 HD23 ' A' ' 5' ' ' LEU . 31.4 tp -70.82 -61.48 1.75 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.744 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.671 HG11 ' HA2' ' A' ' 54' ' ' GLY . 22.7 t -65.56 -31.58 54.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.137 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -100.46 32.8 2.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.99 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.915 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.863 -0.095 . . . . 0.0 112.863 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.7 tptm -63.8 -15.62 59.2 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.705 0.252 . . . . 0.0 111.232 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.831 HD11 ' HB3' ' A' ' 95' ' ' HIS . 0.1 OUTLIER -54.17 -22.15 10.59 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.861 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.48 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 20.5 p-10 -54.41 -45.24 72.92 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.649 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.16 -33.63 19.68 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.296 0.57 . . . . 0.0 109.539 178.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.587 ' C ' HD13 ' A' ' 8' ' ' LEU . 1.7 tm? -87.85 -30.46 20.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.01 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.938 HD12 ' HE3' ' A' ' 48' ' ' MET . 0.4 OUTLIER -65.89 -38.09 87.84 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.082 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -50.51 -40.76 52.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.229 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -47.07 -42.17 18.28 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.075 0.464 . . . . 0.0 110.485 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.015 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -57.31 -61.14 2.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.268 179.234 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.737 ' H ' HD23 ' A' ' 12' ' ' LEU . 1.1 tm0? -50.63 -38.49 46.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.054 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.81 -31.04 61.6 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.832 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -64.97 -29.85 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.735 178.85 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.679 HD21 HD11 ' A' ' 89' ' ' ILE . 3.2 mm? -63.84 -28.43 69.85 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.092 178.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -48.95 -40.97 32.41 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-O 121.155 0.502 . . . . 0.0 110.041 179.364 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.779 ' HB3' HG23 ' A' ' 81' ' ' THR . 8.7 m120 -72.41 -45.67 58.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.79 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.928 HD12 HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -43.93 -49.25 8.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.592 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.735 ' CD2' HD12 ' A' ' 30' ' ' LEU . 43.9 m80 -45.79 -39.38 8.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.098 -179.328 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.468 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 4.3 mmpt? -91.17 6.62 44.36 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -177.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.879 HD21 ' HA3' ' A' ' 78' ' ' GLY . 7.8 m120 -146.5 10.84 1.11 Allowed 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.497 -0.481 . . . . 0.0 112.279 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.922 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -82.07 -35.31 28.8 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.789 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.477 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 85.7 t60 -179.13 -51.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.009 0.433 . . . . 0.0 110.726 179.518 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -134.59 -93.72 0.47 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.903 -0.665 . . . . 0.0 111.747 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -129.13 -148.03 6.5 Favored Glycine 0 N--CA 1.44 -1.081 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.443 ' HD3' ' CE1' ' A' ' 31' ' ' HIS . 7.9 ttmt -94.35 -15.72 24.13 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.626 0.25 . . . . 0.0 111.476 179.583 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -55.91 -52.28 64.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.862 0.363 . . . . 0.0 111.027 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -81.97 -28.57 32.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.598 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.922 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.4 tm? -70.59 -32.24 69.54 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 178.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.443 ' CE1' ' HD3' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -44.51 -55.12 5.36 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.051 179.904 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -20.41 62.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.117 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.98 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.0 OUTLIER -90.01 -60.25 2.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.716 179.799 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.577 ' H ' HD13 ' A' ' 30' ' ' LEU . 1.0 OUTLIER -62.88 -25.62 68.39 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.182 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.412 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 10.8 t-20 -54.7 -37.72 66.15 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 177.674 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.893 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -66.15 -49.61 66.81 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.139 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.952 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -53.09 -67.74 0.23 Allowed 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.824 178.595 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.486 ' O ' HG22 ' A' ' 41' ' ' ILE . 5.6 tt0 -46.25 -43.18 15.32 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.262 -179.566 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -63.73 -24.09 67.63 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.761 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 36' ' ' HIS . 50.8 t -70.55 -56.02 12.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.695 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.775 HD12 HD22 ' A' ' 9' ' ' LEU . 0.1 OUTLIER -44.27 -39.75 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.965 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 3.3 pt-20 -71.15 -32.37 68.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.342 . . . . 0.0 110.404 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.547 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -79.04 -27.04 43.12 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.766 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.702 ' CD1' HG12 ' A' ' 40' ' ' VAL . 20.6 mt -86.92 -26.11 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.109 178.506 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.466 ' NE2' HG13 ' A' ' 41' ' ' ILE . 20.3 m170 -77.88 -57.5 3.77 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.865 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.28 -25.66 67.25 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.072 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.547 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.9 m-85 -88.98 -28.13 20.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.665 179.096 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.938 ' HE3' HD12 ' A' ' 9' ' ' LEU . 1.9 ttt -49.46 -28.56 5.43 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.583 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -29.62 43.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.063 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 129.85 -6.3 6.13 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.905 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.45 -29.78 7.66 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.144 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.438 ' HA3' ' CE2' ' A' ' 47' ' ' PHE . . . -157.73 23.0 0.41 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.287 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.5 p -59.97 165.5 3.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.815 0.341 . . . . 0.0 110.543 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.664 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . 66.46 51.13 44.97 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.531 -0.842 . . . . 0.0 111.995 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 161.19 -24.07 0.24 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.42 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.486 ' HZ3' HD13 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -84.27 -43.19 15.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.682 0.277 . . . . 0.0 111.134 179.854 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.533 ' O ' ' CB ' ' A' ' 61' ' ' MET . 14.3 tp -65.21 -9.66 25.3 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.268 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -86.44 -50.34 6.95 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.793 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -87.33 -31.73 20.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.894 0.378 . . . . 0.0 110.594 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.76 ' HG3' HG13 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -78.19 -28.01 48.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.089 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.533 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.5 OUTLIER -59.32 -41.45 89.09 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.071 179.656 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -71.15 -15.73 62.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.083 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.439 ' HG2' HG22 ' A' ' 40' ' ' VAL . 0.9 OUTLIER -80.96 -25.93 36.99 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.273 -179.81 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.61 ' HB3' HG11 ' A' ' 40' ' ' VAL . 1.2 p90 -86.91 -33.82 19.59 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 121.03 0.443 . . . . 0.0 110.039 179.561 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.455 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 10.5 tt0 -79.14 -35.67 41.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.731 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.6 tp60 -54.06 -33.5 57.63 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.969 0.414 . . . . 0.0 110.477 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.98 HG13 ' CG1' ' A' ' 33' ' ' VAL . 71.8 t -59.41 -39.5 79.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.217 179.262 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 1.031 HD21 HG13 ' A' ' 85' ' ' ILE . 0.5 OUTLIER -76.19 -5.67 47.82 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.394 178.68 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -75.68 -56.87 4.27 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.487 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 0.5 OUTLIER -53.57 -38.12 63.58 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 122.143 0.973 . . . . 0.0 108.674 177.594 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.958 HD21 HG13 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -72.41 -67.36 0.56 Allowed 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 113.434 -1.712 . . . . 0.0 111.848 -179.345 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.422 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 65.9 t30 -51.04 -26.08 5.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.508 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -88.11 9.38 22.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.367 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.502 ' O ' ' N ' ' A' ' 76' ' ' GLN . 73.0 m-70 -154.97 32.31 0.4 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 111.768 0.284 . . . . 0.0 111.768 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.568 HD21 ' HB ' ' A' ' 82' ' ' VAL . 0.2 OUTLIER -52.67 88.31 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.086 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.502 ' N ' ' O ' ' A' ' 74' ' ' HIS . 1.2 mm-40 -67.97 69.7 0.13 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.441 . . . . 0.0 111.171 -178.281 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 60.88 21.57 58.88 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.584 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.879 ' HA3' HD21 ' A' ' 22' ' ' ASN . . . -121.94 39.41 2.33 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.312 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.467 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -49.26 -40.65 35.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.866 0.365 . . . . 0.0 111.469 -179.767 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 1.9 m170 -55.43 -33.9 63.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.58 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.779 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.3 m -67.45 -74.41 0.12 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.958 HG13 HD21 ' A' ' 71' ' ' LEU . 39.7 t -51.12 -40.73 22.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.083 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.469 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 56.6 t-80 -49.84 -40.88 43.75 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -76.54 -28.35 56.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.635 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 1.031 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.3 -33.13 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.962 -179.589 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.506 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.2 OUTLIER -74.38 -46.53 39.82 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.851 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.35 -30.28 66.61 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.796 ' O ' HD13 ' A' ' 92' ' ' ILE . 2.5 m-80 -82.75 -68.15 0.73 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.335 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 1.015 ' CG1' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -50.53 -45.76 26.47 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.473 -179.761 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.414 ' N ' HG22 ' A' ' 89' ' ' ILE . 1.2 mmmm -62.53 -30.21 71.12 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.734 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -90.75 -2.32 57.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.278 178.462 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.796 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -78.68 -35.63 18.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.634 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -65.37 -30.81 71.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.506 179.177 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.634 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.1 OUTLIER -59.88 -57.09 14.38 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.318 -179.207 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.831 ' HB3' HD11 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -69.81 -9.96 56.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.387 178.87 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.676 HD21 ' HG ' ' A' ' 9' ' ' LEU . 35.5 mt -89.43 -54.24 4.18 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.456 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.405 ' HG2' HD23 ' A' ' 57' ' ' LEU . 1.6 mt-10 -62.97 -13.15 31.36 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 177.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.43 ' O ' ' CB ' ' A' ' 102' ' ' ARG . 0.1 OUTLIER -80.75 -1.3 42.22 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.836 179.383 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.668 HD21 ' HB2' ' A' ' 5' ' ' LEU . 4.1 mt -96.1 -67.2 0.86 Allowed 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.127 0.489 . . . . 0.0 110.597 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.664 HG11 ' HA2' ' A' ' 54' ' ' GLY . 41.3 t -59.78 -27.45 38.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.946 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 97' ' ' GLU . 10.9 t-80 -86.91 -33.08 19.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.107 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.43 ' CB ' ' O ' ' A' ' 98' ' ' GLU . 38.2 ttp180 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.952 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.48 ' HA2' ' HG3' ' A' ' 48' ' ' MET . . . . . . . . 0 N--CA 1.45 -0.381 0 N-CA-C 112.609 -0.196 . . . . 0.0 112.609 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.7 tptt -55.87 -19.55 12.25 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.54 0.17 . . . . 0.0 111.241 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.863 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -49.65 -23.51 1.76 Allowed 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.35 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.422 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 12.2 p30 -58.42 -42.74 87.9 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.742 178.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -48.81 -30.6 5.91 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.273 0.558 . . . . 0.0 109.752 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.835 ' O ' HD13 ' A' ' 8' ' ' LEU . 2.2 tm? -83.64 -35.58 24.49 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.933 178.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.678 ' HB3' HD11 ' A' ' 41' ' ' ILE . 7.9 mt -62.23 -40.95 97.87 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.82 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -49.0 -44.26 40.99 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.683 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.407 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 0.9 OUTLIER -49.71 -45.74 49.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.101 -179.821 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.954 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -56.54 -61.64 2.28 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.717 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.574 ' H ' HD23 ' A' ' 12' ' ' LEU . 0.9 OUTLIER -51.53 -39.3 57.44 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.481 -179.138 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -75.53 -28.77 59.2 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.856 HG13 ' HB ' ' A' ' 85' ' ' ILE . 0.3 OUTLIER -67.69 -27.42 38.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.976 179.031 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.711 ' CD1' HD13 ' A' ' 19' ' ' LEU . 2.9 mm? -64.8 -29.7 70.68 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.722 178.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.433 ' HA ' ' ND1' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -47.51 -39.95 17.42 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.21 0.529 . . . . 0.0 110.075 179.277 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.859 ' HB3' HG23 ' A' ' 81' ' ' THR . 2.1 m120 -73.82 -45.49 51.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.072 178.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.858 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -46.9 -42.95 18.39 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.618 -179.836 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.761 ' CD2' HD12 ' A' ' 30' ' ' LEU . 40.5 m80 -48.81 -40.82 30.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.869 0.366 . . . . 0.0 111.734 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.5 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 3.9 mmpt? -89.2 5.78 43.17 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.697 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.697 ' O ' HD13 ' A' ' 75' ' ' LEU . 3.8 m120 -142.03 5.21 1.7 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.468 -0.493 . . . . 0.0 112.274 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.912 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -81.07 -51.91 7.97 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.738 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.518 ' HB3' ' CZ2' ' A' ' 23' ' ' TRP . 8.7 t-160 179.56 58.67 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.939 0.4 . . . . 0.0 110.876 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 116.72 -104.05 1.18 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.061 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -128.81 -146.24 6.14 Favored Glycine 0 N--CA 1.443 -0.9 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.961 179.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.49 ' HG3' ' CD2' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -94.18 -13.28 26.84 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -49.14 -62.66 1.41 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.8 m-80 -77.32 -27.83 53.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.695 0.283 . . . . 0.0 110.728 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.912 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.3 tm? -68.37 -31.18 70.37 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.449 ' N ' ' O ' ' A' ' 27' ' ' LYS . 3.8 t-80 -45.25 -58.69 3.1 Favored 'General case' 0 CA--C 1.523 -0.091 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.803 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.4 -21.99 52.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.015 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.96 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.5 t -87.09 -64.93 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.691 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.616 ' H ' HD13 ' A' ' 30' ' ' LEU . 1.1 t70 -59.46 -21.67 60.41 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.234 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -59.8 -39.84 86.35 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.982 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.3 m-70 -63.51 -52.57 60.64 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 177.384 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.949 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -54.59 -67.31 0.28 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.684 178.328 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.807 ' O ' HG22 ' A' ' 41' ' ' ILE . 3.6 tt0 -47.41 -43.49 23.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.182 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -66.86 -25.2 66.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.546 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.982 HG23 ' O ' ' A' ' 36' ' ' HIS . 81.3 t -75.21 -39.86 43.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.218 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.807 HG22 ' O ' ' A' ' 38' ' ' GLN . 6.9 tp -43.23 -35.45 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.184 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -75.86 -40.82 53.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.192 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.792 ' OD2' HG13 ' A' ' 40' ' ' VAL . 4.2 p30 -62.14 -30.79 71.28 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.583 HG13 ' O ' ' A' ' 40' ' ' VAL . 2.3 mt -86.84 -40.55 14.14 Favored 'Isoleucine or valine' 0 C--N 1.337 0.051 0 CA-C-O 121.043 0.449 . . . . 0.0 109.972 178.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.406 ' NE2' HG13 ' A' ' 41' ' ' ILE . 18.6 m170 -59.39 -40.97 88.26 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.423 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -82.59 -10.02 59.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.803 178.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.533 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -87.8 -36.7 17.13 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.161 -179.847 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.48 ' HG3' ' HA2' ' A' ' 3' ' ' GLY . 10.2 ptt? -49.06 -28.8 4.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.296 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -79.07 -21.48 46.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.469 -179.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 117.29 -6.22 17.05 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.558 -0.829 . . . . 0.0 113.04 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.43 -28.62 6.66 Favored Glycine 0 C--N 1.334 0.422 0 C-N-CA 120.571 -0.823 . . . . 0.0 112.078 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -156.09 27.67 0.57 Allowed Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.521 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 25.8 p -74.0 148.37 42.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.025 0.44 . . . . 0.0 111.381 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 74.42 52.96 7.02 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 115.703 -0.681 . . . . 0.0 112.762 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 162.74 -35.03 0.33 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.386 -0.912 . . . . 0.0 113.274 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.48 ' HE2' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -88.35 -38.96 14.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.95 0.375 . . . . 0.0 111.759 -179.478 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.557 ' O ' ' HB3' ' A' ' 61' ' ' MET . 47.1 tp -60.51 -10.91 5.65 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.51 ' O ' ' HG3' ' A' ' 61' ' ' MET . 14.2 pt20 -85.74 -49.33 8.03 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.837 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.41 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 3.7 mt-10 -87.58 -28.94 21.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.95 0.405 . . . . 0.0 110.328 179.165 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.402 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -77.18 -33.92 56.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.91 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.557 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -53.64 -41.43 66.73 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.106 0.479 . . . . 0.0 110.389 179.748 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 19.1 mmtt -57.75 -24.21 55.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.939 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.651 ' HB3' HG21 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -68.75 -42.91 76.88 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.424 -179.785 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.853 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.7 p90 -69.92 -29.66 66.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.923 0.392 . . . . 0.0 110.421 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -82.41 -30.58 30.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.41 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.59 -41.25 73.1 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.605 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.96 HG13 ' CG1' ' A' ' 33' ' ' VAL . 14.6 t -56.15 -50.09 72.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.027 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 1.016 HD21 HG13 ' A' ' 85' ' ' ILE . 0.4 OUTLIER -63.13 -16.38 59.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.618 179.13 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -65.62 -61.19 2.23 Favored 'General case' 0 C--O 1.231 0.097 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.476 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -51.06 -36.59 40.74 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.906 0.86 . . . . 0.0 109.401 178.175 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.895 HD21 HG13 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -70.68 -69.11 0.38 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 113.745 -1.57 . . . . 0.0 112.336 -178.884 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.418 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 2.6 m-20 -50.25 -26.26 4.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.56 -179.247 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -88.69 9.8 23.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.506 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.625 ' O ' ' N ' ' A' ' 76' ' ' GLN . 79.0 m-70 -153.82 28.72 0.47 Allowed 'General case' 0 CA--C 1.52 -0.18 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.697 HD13 ' O ' ' A' ' 22' ' ' ASN . 0.3 OUTLIER -49.38 85.3 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.016 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.625 ' N ' ' O ' ' A' ' 74' ' ' HIS . 16.9 mm-40 -82.05 -37.74 26.0 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.052 -177.501 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -83.75 -58.07 2.32 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.223 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 174.53 121.82 0.65 Allowed Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.231 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.572 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 1.3 mtmt -42.75 -30.41 0.38 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -43.18 -35.02 1.25 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.76 0.314 . . . . 0.0 111.417 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.859 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.4 m -69.93 -74.23 0.14 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.895 HG13 HD21 ' A' ' 71' ' ' LEU . 27.3 t -48.58 -38.44 9.45 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.403 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.098 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.472 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 4.6 t60 -50.77 -41.29 56.65 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.387 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -76.2 -28.14 57.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.624 178.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 1.016 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.67 -33.6 7.79 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.14 -179.748 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.554 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -75.3 -45.42 39.9 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.801 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.466 ' O ' ' HB2' ' A' ' 91' ' ' GLU . 1.5 mp0 -59.62 -29.66 68.15 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 178.121 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.732 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.9 m-80 -82.96 -63.58 1.34 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.438 179.089 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 1.003 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -55.03 -43.77 71.12 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.22 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.468 -179.73 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -63.37 -29.32 70.65 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.133 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 87' ' ' GLN . 0.4 OUTLIER -90.39 -6.81 54.53 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.102 178.522 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.732 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -72.9 -42.25 60.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.638 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -58.47 -27.65 64.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.365 178.763 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.638 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.0 OUTLIER -62.47 -63.88 1.09 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.169 -179.222 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.653 ' HB3' HD11 ' A' ' 5' ' ' LEU . 11.8 m80 -64.21 -10.5 23.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.144 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.596 HD11 HD21 ' A' ' 9' ' ' LEU . 31.3 mt -88.52 -55.57 3.67 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.086 0.47 . . . . 0.0 110.061 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.416 ' N ' HD21 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -72.9 -7.88 53.0 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.932 178.7 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -90.96 -25.26 19.84 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.758 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.863 HD13 HD23 ' A' ' 5' ' ' LEU . 15.9 tp -70.17 -52.77 20.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.157 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 33.4 t -69.64 -27.99 35.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.423 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -77.51 -38.58 48.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.761 0.315 . . . . 0.0 110.975 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.953 -179.897 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.181 -0.368 . . . . 0.0 112.181 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.77 -16.67 61.77 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 120.567 0.222 . . . . 0.0 110.589 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 1.043 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -51.39 -23.92 4.31 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 177.878 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.512 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 23.4 t-20 -63.64 -46.51 85.36 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.612 178.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -48.62 -35.12 12.96 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.625 HD13 ' O ' ' A' ' 8' ' ' LEU . 2.5 tm? -88.07 -29.13 20.87 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.144 178.475 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.814 ' HG ' HD21 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -70.06 -33.03 71.42 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.056 0.455 . . . . 0.0 110.292 179.829 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -54.54 -40.68 68.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.235 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.459 ' HA ' ' HG2' ' A' ' 14' ' ' GLU . 0.4 OUTLIER -48.32 -43.77 33.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.931 0.396 . . . . 0.0 110.848 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.992 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -57.79 -60.53 3.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.768 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.638 ' H ' HD23 ' A' ' 12' ' ' LEU . 4.8 tp60 -51.47 -41.36 60.84 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.555 -179.129 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.459 ' HG2' ' HA ' ' A' ' 11' ' ' ASP . 10.8 pt-20 -74.21 -22.02 59.55 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.846 0.355 . . . . 0.0 110.203 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.865 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -74.21 -27.14 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.254 179.249 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.818 HD21 HD11 ' A' ' 89' ' ' ILE . 3.1 mm? -65.54 -34.62 78.68 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.356 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.82 -42.99 8.35 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 121.104 0.478 . . . . 0.0 110.247 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.668 ' HB3' HG23 ' A' ' 81' ' ' THR . 0.3 OUTLIER -68.35 -42.86 78.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.477 0.656 . . . . 0.0 109.263 178.595 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.875 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -53.66 -37.05 62.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.814 179.683 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.989 ' CE1' HD12 ' A' ' 30' ' ' LEU . 49.3 m-70 -54.04 -34.48 60.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.386 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.537 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.4 mmpt? -94.29 3.39 55.28 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -138.91 -1.43 1.79 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.94 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -72.88 -56.02 5.79 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.21 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.588 ' HB3' ' CH2' ' A' ' 23' ' ' TRP . 8.2 t-160 179.04 47.18 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.843 178.269 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 51.26 172.57 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.106 -0.569 . . . . 0.0 113.205 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.6 78.92 0.13 Allowed Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 121.012 -0.614 . . . . 0.0 112.283 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -27.05 5.52 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.95 -30.65 66.14 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.85 178.666 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -78.81 -40.51 32.77 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.01 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.989 HD12 ' CE1' ' A' ' 20' ' ' HIS . 1.1 tm? -65.97 -36.38 83.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.383 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.43 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.3 OUTLIER -46.48 -43.43 16.71 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.239 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.5 -21.3 55.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.467 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.867 HG11 HD22 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -88.3 -46.36 15.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.11 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.515 ' HB2' HD11 ' A' ' 30' ' ' LEU . 2.6 t0 -74.58 -34.33 62.86 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 179.374 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 17.6 t-20 -53.28 -29.17 31.81 Favored 'General case' 0 C--N 1.334 -0.077 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.814 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -57.05 -52.95 63.22 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.806 178.815 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.805 ' CD1' HD21 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -77.1 -32.71 56.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.826 178.825 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.592 ' O ' HG22 ' A' ' 41' ' ' ILE . 2.2 tm0? -54.96 -37.47 66.53 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -83.42 -18.3 39.18 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.952 178.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.814 HG23 ' O ' ' A' ' 36' ' ' HIS . 55.3 t -75.97 -40.81 38.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.125 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.592 HG22 ' O ' ' A' ' 38' ' ' GLN . 2.3 tp -45.53 -35.9 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.278 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.41 ' O ' ' CB ' ' A' ' 46' ' ' ASP . 0.4 OUTLIER -75.56 -28.03 58.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.561 179.546 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 1.3 m-20 -79.38 -26.32 42.01 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.737 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.636 HD11 HG12 ' A' ' 40' ' ' VAL . 2.8 mt -86.17 -57.69 4.08 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.856 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.492 ' HA ' ' HE2' ' A' ' 48' ' ' MET . 0.1 OUTLIER -58.76 -27.31 64.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.04 -179.948 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.41 ' CB ' ' O ' ' A' ' 42' ' ' GLU . 27.6 t0 -86.67 -26.36 24.35 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.568 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.9 m-85 -83.74 -52.49 6.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.273 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.509 ' SD ' HG22 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -51.97 -21.64 3.23 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.399 -179.411 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.08 16.09 10.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.348 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 102.41 31.99 5.04 Favored Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.89 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.41 ' CA ' ' HA ' ' A' ' 47' ' ' PHE . . . -111.22 24.98 14.71 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.614 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.72 25.74 9.63 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.643 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -20.02 55.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.636 0.255 . . . . 0.0 111.235 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.624 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -77.02 70.86 2.28 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.982 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.47 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . 133.64 -7.33 4.91 Favored Glycine 0 CA--C 1.518 0.223 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.953 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.926 ' NZ ' HD22 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -88.73 -37.48 15.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.669 0.271 . . . . 0.0 111.213 -179.89 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.926 HD22 ' NZ ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -63.59 -11.98 29.29 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.248 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 1.7 pp0? -86.03 -49.92 7.44 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.551 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -86.92 -30.46 21.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.753 0.311 . . . . 0.0 110.576 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.602 ' HG2' HG13 ' A' ' 40' ' ' VAL . 0.6 OUTLIER -77.88 -31.06 51.13 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.753 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.482 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -55.17 -33.82 63.3 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.896 0.379 . . . . 0.0 110.489 179.771 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 66' ' ' GLN . 31.3 tttt -67.39 -26.15 66.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.092 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.746 ' HB3' HG21 ' A' ' 40' ' ' VAL . 2.4 tp10 -70.51 -37.25 74.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.692 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.483 ' HA ' ' HB2' ' A' ' 37' ' ' LEU . 0.3 OUTLIER -85.09 -27.8 26.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.939 0.4 . . . . 0.0 110.438 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -82.45 -29.9 30.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.231 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.407 ' HB2' ' O ' ' A' ' 62' ' ' LYS . 1.1 tm0? -62.7 -36.09 81.83 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.597 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.818 HG22 ' O ' ' A' ' 33' ' ' VAL . 72.1 t -52.18 -39.97 28.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.7 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 1.06 HD21 HG13 ' A' ' 85' ' ' ILE . 1.0 OUTLIER -73.67 -5.3 39.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.004 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' A' ' 66' ' ' GLN . 2.2 m-20 -78.08 -56.38 4.52 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.899 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.507 ' CB ' HG21 ' A' ' 33' ' ' VAL . 4.8 tp10 -52.43 -32.5 39.66 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 122.029 0.919 . . . . 0.0 108.788 177.725 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.875 HD13 ' CG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -79.13 -64.98 1.06 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.883 -179.106 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.425 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 65.2 t30 -50.46 -24.73 3.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.748 -179.277 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -88.74 3.89 49.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.817 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.497 ' O ' ' N ' ' A' ' 76' ' ' GLN . 91.3 m-70 -147.19 26.97 1.06 Allowed 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.577 HD11 HG23 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -49.5 91.95 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.027 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 74' ' ' HIS . 13.2 tt0 -64.54 68.23 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.594 -178.054 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 56.33 29.08 56.19 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.666 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.465 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -138.96 48.92 0.84 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.385 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.536 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -55.42 -36.09 66.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.541 0.21 . . . . 0.0 111.496 -179.764 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -45.26 -32.87 2.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.636 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.668 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -69.69 -74.64 0.13 Allowed 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.158 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.849 HG13 HD21 ' A' ' 71' ' ' LEU . 38.3 t -48.83 -38.81 10.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.98 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.473 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -50.26 -41.57 50.63 Favored 'General case' 0 CA--C 1.522 -0.12 0 CA-C-O 121.145 0.498 . . . . 0.0 109.713 179.405 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -76.16 -27.21 56.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.564 178.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 1.06 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.52 -35.76 10.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.074 -179.846 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -71.24 -44.69 64.83 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.477 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -61.53 -29.05 69.75 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.374 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.729 ' O ' HD13 ' A' ' 92' ' ' ILE . 2.1 m-80 -83.01 -64.75 1.11 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.222 178.78 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.992 ' CG1' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -54.12 -50.85 52.01 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.41 -179.745 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.433 ' N ' HG22 ' A' ' 89' ' ' ILE . 7.2 mmmt -59.78 -29.5 68.24 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.007 -0.677 . . . . 0.0 109.725 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -90.83 -3.23 57.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.361 178.49 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.729 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -78.69 -40.09 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.633 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -60.01 -26.41 66.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.298 178.886 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.633 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 4.0 t60 -62.35 -65.44 0.69 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.157 -179.25 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.507 ' HB3' HD11 ' A' ' 5' ' ' LEU . 1.5 m-70 -61.7 -10.71 9.24 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.207 178.589 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.814 HD21 ' HG ' ' A' ' 9' ' ' LEU . 44.2 mt -89.34 -63.5 1.28 Allowed 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.943 0.401 . . . . 0.0 110.566 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -67.87 -11.77 59.32 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.324 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.421 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 0.9 OUTLIER -89.7 -13.12 37.58 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.879 179.565 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 1.043 HD13 HD23 ' A' ' 5' ' ' LEU . 10.0 tp -82.01 -56.45 3.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.016 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.624 HG11 ' HA2' ' A' ' 54' ' ' GLY . 40.9 t -66.67 -43.77 90.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.499 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -59.86 -28.33 67.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.015 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 32.7 ttt-85 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.859 179.938 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 CA-C-O 120.442 -0.088 . . . . 0.0 112.9 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -87.96 -19.41 27.28 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.744 0.272 . . . . 0.0 110.74 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 1.038 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -54.62 -19.3 5.76 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.728 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -61.15 -44.9 96.59 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.961 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -49.75 -28.08 5.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.045 0.45 . . . . 0.0 110.139 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.714 ' O ' HD22 ' A' ' 8' ' ' LEU . 1.2 tm? -87.64 -28.24 21.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.409 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.519 HD11 HG21 ' A' ' 44' ' ' ILE . 8.7 mt -73.18 -38.6 66.1 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.858 0.361 . . . . 0.0 110.774 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -42.83 -32.85 0.67 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.446 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.0 -52.2 13.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.519 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.917 ' O ' HG12 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -50.98 -43.2 60.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.301 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.841 ' N ' HD13 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -73.51 -38.08 65.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.626 0.251 . . . . 0.0 111.5 -179.869 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -73.89 -27.58 61.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.08 0.467 . . . . 0.0 110.132 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.917 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.9 OUTLIER -64.83 -24.34 35.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.333 179.163 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.697 HD12 HD13 ' A' ' 19' ' ' LEU . 1.1 mm? -66.49 -37.94 86.17 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.237 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.48 -33.17 1.62 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 121.172 0.511 . . . . 0.0 110.288 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.475 ' HB3' HG23 ' A' ' 81' ' ' THR . 34.3 m-80 -76.79 -45.84 27.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.903 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.971 HD21 HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -47.85 -42.61 26.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.267 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 1.033 ' CE1' HD12 ' A' ' 30' ' ' LEU . 56.3 m-70 -48.43 -42.46 32.32 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.266 -0.424 . . . . 0.0 112.035 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.444 ' HE3' ' C ' ' A' ' 20' ' ' HIS . 0.0 OUTLIER -86.24 5.01 36.33 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -177.248 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.779 ' O ' HD13 ' A' ' 75' ' ' LEU . 9.0 m-80 -146.01 12.63 1.26 Allowed 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.383 -0.527 . . . . 0.0 112.135 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.802 ' CA ' HD12 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -84.78 -33.59 22.97 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.893 179.87 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.505 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 3.1 t-160 -178.32 -51.18 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.646 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.81 138.73 2.96 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.755 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.44 104.37 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.394 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.4 tttt -53.01 -23.79 8.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.697 0.284 . . . . 0.0 110.775 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -50.91 -31.94 19.15 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.804 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -85.99 -46.91 10.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.496 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.033 HD12 ' CE1' ' A' ' 20' ' ' HIS . 2.0 tm? -60.31 -29.96 69.19 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.404 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 17.0 t-160 -45.69 -56.44 5.25 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.694 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.12 -24.1 62.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.967 0.413 . . . . 0.0 110.779 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.982 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.3 t -84.66 -66.1 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.522 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.623 ' N ' HG12 ' A' ' 33' ' ' VAL . 1.0 OUTLIER -57.87 -23.25 52.2 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.298 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.404 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 16.3 m-20 -56.97 -39.44 74.61 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 177.406 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.702 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -66.54 -45.63 78.79 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.72 -1.127 . . . . 0.0 108.028 177.366 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.992 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -56.7 -67.13 0.34 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.794 178.612 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -44.58 -41.79 6.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.056 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -62.21 -29.8 70.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.299 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.847 HG11 ' HB3' ' A' ' 64' ' ' PHE . 97.6 t -62.54 -54.82 28.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.27 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.669 HD11 HD11 ' A' ' 12' ' ' LEU . 17.3 mm -42.5 -46.13 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.938 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 1.1 pt-20 -68.02 -29.86 68.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.884 0.373 . . . . 0.0 110.405 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.546 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.9 OUTLIER -81.39 -25.2 36.45 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.921 -0.582 . . . . 0.0 109.96 178.848 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.572 HG12 ' O ' ' A' ' 40' ' ' VAL . 9.1 mm -87.17 -38.19 11.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.67 179.152 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.638 ' NE2' HG23 ' A' ' 41' ' ' ILE . 11.6 m170 -78.03 -42.3 32.93 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.633 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -72.04 -27.6 62.81 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.82 0.343 . . . . 0.0 110.47 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.546 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.8 m-85 -88.48 -45.61 9.8 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.485 ' HE1' ' N ' ' A' ' 5' ' ' LEU . 8.1 ptm -46.7 -38.16 9.45 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 120.813 0.34 . . . . 0.0 111.443 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.47 -21.33 66.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.299 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 133.05 24.93 0.69 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.945 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -102.29 35.25 5.09 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.137 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.11 32.57 4.29 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.221 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.72 ' O ' HG11 ' A' ' 100' ' ' VAL . 88.8 p -59.61 -22.48 61.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.687 0.28 . . . . 0.0 111.107 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -91.91 75.1 1.44 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.52 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 145.26 -17.14 1.9 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.619 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.476 ' HE3' ' HB2' ' A' ' 47' ' ' PHE . 2.9 pptp? -88.21 -39.97 14.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.783 0.325 . . . . 0.0 110.915 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' A' ' 96' ' ' LEU . 7.0 tp -65.85 -9.38 28.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.943 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -86.15 -50.08 7.27 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.311 -0.556 . . . . 0.0 110.696 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -87.39 -30.68 20.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.474 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.803 ' HG3' HG13 ' A' ' 40' ' ' VAL . 17.5 tpp -78.14 -33.11 50.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.163 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.528 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 2.4 tmm? -56.12 -41.97 76.12 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 120.189 -0.604 . . . . 0.0 109.843 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.04 -26.69 65.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.918 178.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.463 ' HB3' HG22 ' A' ' 40' ' ' VAL . 0.7 OUTLIER -65.27 -34.4 78.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.049 179.929 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.847 ' HB3' HG11 ' A' ' 40' ' ' VAL . 0.9 OUTLIER -87.38 -26.46 23.31 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.851 0.358 . . . . 0.0 110.606 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -82.64 -32.41 28.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.826 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -57.41 -39.3 75.87 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.202 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.992 HG21 ' HB2' ' A' ' 37' ' ' LEU . 13.0 t -50.19 -44.67 23.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.005 0.431 . . . . 0.0 110.584 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 1.034 HD11 HD13 ' A' ' 89' ' ' ILE . 0.7 OUTLIER -66.25 -13.81 60.96 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.059 179.534 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -67.84 -58.61 4.3 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.494 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 1.9 tp10 -52.81 -37.51 60.04 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 122.0 0.905 . . . . 0.0 109.486 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.871 HD21 HG13 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -72.11 -69.4 0.4 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.652 -1.613 . . . . 0.0 112.565 -178.76 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.12 -26.69 4.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.687 -179.138 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -90.97 12.4 19.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.244 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.6 ' O ' ' N ' ' A' ' 76' ' ' GLN . 79.4 m-70 -156.33 30.08 0.34 Allowed 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.779 HD13 ' O ' ' A' ' 22' ' ' ASN . 0.2 OUTLIER -50.7 85.25 0.0 OUTLIER 'General case' 0 C--O 1.232 0.157 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.89 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.6 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -81.49 -37.54 27.76 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.837 -177.637 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -82.21 -65.85 1.61 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.783 -0.722 . . . . 0.0 113.183 -179.102 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -179.12 120.12 0.68 Allowed Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.171 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.51 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -40.08 -30.71 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.672 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -44.75 -34.46 2.28 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.848 0.356 . . . . 0.0 111.263 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.699 HG21 ' HB2' ' A' ' 22' ' ' ASN . 1.8 m -68.67 -73.26 0.15 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.05 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.871 HG13 HD21 ' A' ' 71' ' ' LEU . 24.3 t -50.24 -38.8 15.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.169 179.671 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.443 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -48.83 -40.83 30.84 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.401 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -76.2 -29.46 57.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.62 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.98 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.54 -35.4 9.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.36 -179.529 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -73.79 -39.62 64.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.697 0.284 . . . . 0.0 110.248 179.316 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.418 ' O ' ' CB ' ' A' ' 91' ' ' GLU . 2.3 mp0 -67.07 -31.05 71.28 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.497 ' O ' HD13 ' A' ' 92' ' ' ILE . 2.9 m-80 -83.02 -44.24 15.44 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.594 179.26 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 1.034 HD13 HD11 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -74.1 -54.87 13.88 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.564 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.275 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.569 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 5.9 mmmt -58.56 -28.98 66.02 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.224 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.418 ' CB ' ' O ' ' A' ' 87' ' ' GLN . 2.1 tt0 -90.92 -2.62 57.71 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.561 ' HB ' ' HA ' ' A' ' 89' ' ' ILE . 1.2 tp -78.82 -49.06 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.321 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.649 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.2 OUTLIER -48.29 -26.34 1.96 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.49 179.284 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.649 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 20.6 t-80 -65.1 -66.74 0.5 Allowed 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.816 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.493 ' HB3' HD11 ' A' ' 5' ' ' LEU . 1.0 OUTLIER -60.79 -12.79 11.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.982 -0.553 . . . . 0.0 109.894 178.242 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.602 ' HB3' HD21 ' A' ' 57' ' ' LEU . 22.1 mt -86.04 -64.96 1.07 Allowed 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 120.952 0.406 . . . . 0.0 110.133 179.206 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.543 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -62.31 -16.7 55.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.789 178.694 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -86.96 2.67 48.66 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.668 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 1.038 HD13 HD23 ' A' ' 5' ' ' LEU . 16.5 tp -100.81 -63.02 1.17 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.969 0.414 . . . . 0.0 110.796 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.72 HG11 ' O ' ' A' ' 53' ' ' SER . 39.8 t -61.86 -28.73 44.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.391 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 38.2 m170 -96.59 33.63 1.8 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.021 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.874 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.517 ' O ' ' HE3' ' A' ' 48' ' ' MET . . . . . . . . 0 N--CA 1.451 -0.353 0 N-CA-C 112.777 -0.129 . . . . 0.0 112.777 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 26.6 tptp -95.57 -21.17 18.43 Favored 'General case' 0 CA--C 1.507 -0.674 0 CA-C-O 120.599 0.237 . . . . 0.0 110.637 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.875 HD23 HD13 ' A' ' 99' ' ' LEU . 0.2 OUTLIER -52.04 -23.12 4.77 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.261 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.56 ' HB3' ' HE1' ' A' ' 48' ' ' MET . 26.4 p-10 -60.02 -40.18 88.42 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.569 178.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -49.84 -29.83 8.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.123 0.487 . . . . 0.0 110.027 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.617 ' C ' HD13 ' A' ' 8' ' ' LEU . 2.4 tm? -85.06 -31.25 23.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.247 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.999 HD23 HD22 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -68.3 -33.72 74.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.459 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -48.58 -45.51 38.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.324 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.413 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -57.38 -40.67 78.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.776 179.94 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.999 HD21 HD11 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -59.51 -63.4 1.32 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.747 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.89 ' HA ' HD23 ' A' ' 16' ' ' LEU . 13.0 tt0 -48.61 -41.17 30.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.617 -179.041 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -71.38 -30.12 65.76 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.101 0.477 . . . . 0.0 109.867 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.975 HG13 HG13 ' A' ' 85' ' ' ILE . 0.4 OUTLIER -66.11 -23.77 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.225 178.9 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 1.066 HD13 HD11 ' A' ' 85' ' ' ILE . 3.8 mm? -67.7 -33.92 75.86 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 177.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.422 ' HA ' ' CE ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -42.05 -42.16 2.8 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 121.189 0.518 . . . . 0.0 109.971 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.758 ' HB3' HG23 ' A' ' 81' ' ' THR . 6.4 m-20 -64.37 -49.11 72.94 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.258 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.892 HD12 HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -48.15 -57.16 6.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.719 -179.999 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 1.023 ' CE1' HD12 ' A' ' 30' ' ' LEU . 40.8 m-70 -45.25 -27.62 0.67 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.528 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.4 mmpt? -94.29 -20.09 20.1 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -177.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.477 ' O ' HD13 ' A' ' 75' ' ' LEU . 25.3 m120 -122.99 -6.25 8.43 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.997 ' CB ' HD12 ' A' ' 71' ' ' LEU . 0.2 OUTLIER -59.66 -33.28 71.34 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.894 -179.793 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.529 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 78.7 t60 -175.97 -52.65 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.566 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.5 129.35 1.73 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.844 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 71.55 115.09 0.05 OUTLIER Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.354 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -58.66 -18.61 32.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.569 0.224 . . . . 0.0 110.862 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -51.64 -38.1 53.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.627 0.251 . . . . 0.0 110.927 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -83.79 -44.63 14.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.466 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.023 HD12 ' CE1' ' A' ' 20' ' ' HIS . 1.4 tm? -62.1 -27.3 68.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.137 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.494 ' O ' ' ND2' ' A' ' 35' ' ' ASN . 0.2 OUTLIER -48.62 -36.09 15.05 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.627 179.876 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.11 -25.07 55.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.975 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.85 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.9 t -87.45 -56.67 5.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.758 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.637 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -59.02 -25.39 63.63 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.475 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.494 ' ND2' ' O ' ' A' ' 31' ' ' HIS . 0.7 OUTLIER -58.73 -40.41 83.69 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 178.145 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.885 ' O ' HG23 ' A' ' 40' ' ' VAL . 2.7 m170 -63.48 -49.78 72.27 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 177.777 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.042 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -55.47 -67.92 0.24 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.55 178.379 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.3 tm0? -45.68 -42.8 12.03 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.016 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -61.89 -30.69 71.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.326 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.885 HG23 ' O ' ' A' ' 36' ' ' HIS . 61.8 t -64.39 -52.69 52.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.357 179.344 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.999 HD11 HD21 ' A' ' 12' ' ' LEU . 1.5 mp -42.77 -41.15 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.722 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 0.1 OUTLIER -72.77 -28.3 62.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.925 0.393 . . . . 0.0 110.429 179.775 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.519 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 1.1 m-20 -84.03 -28.87 27.35 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.899 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.767 ' CG1' HG12 ' A' ' 40' ' ' VAL . 18.2 mm -86.67 -39.01 12.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.972 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.706 ' CE1' HG23 ' A' ' 41' ' ' ILE . 11.6 m170 -77.94 -36.55 49.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.643 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.409 ' CB ' ' O ' ' A' ' 42' ' ' GLU . 9.8 t70 -76.62 -27.67 55.81 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.67 0.271 . . . . 0.0 110.533 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.519 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 4.1 m-85 -88.35 -43.4 11.54 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.908 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.56 ' HE1' ' HB3' ' A' ' 6' ' ' ASN . 25.5 ptt? -46.6 -29.57 1.88 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.807 0.337 . . . . 0.0 111.457 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -68.61 -28.11 66.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.105 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 141.21 -12.5 2.8 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.875 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -55.13 -22.63 29.61 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.716 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 155.21 55.0 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.281 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.478 ' OG ' HG22 ' A' ' 100' ' ' VAL . 1.2 t -76.17 -20.16 57.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.601 0.239 . . . . 0.0 111.39 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.8 74.03 2.11 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.542 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 145.6 -17.52 1.84 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.637 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.452 ' O ' ' CB ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.18 -43.08 11.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.673 0.273 . . . . 0.0 111.086 179.893 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.51 ' O ' ' CB ' ' A' ' 61' ' ' MET . 44.9 tp -64.34 -10.29 23.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.739 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -85.97 -49.75 7.6 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.853 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -87.14 -30.13 21.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.343 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.642 ' HG3' HG13 ' A' ' 40' ' ' VAL . 3.7 tpt -78.11 -31.39 49.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.861 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.51 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -56.16 -39.01 71.65 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.315 179.714 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.69 -11.57 60.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.144 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -84.82 -26.25 27.57 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.46 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.478 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.4 p90 -87.19 -28.81 22.19 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.749 0.309 . . . . 0.0 110.92 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.38 -30.28 30.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.701 179.519 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -30.7 67.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.825 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 1.042 HG21 ' HB2' ' A' ' 37' ' ' LEU . 24.3 t -57.43 -59.87 2.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.566 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 1.071 HD11 HD13 ' A' ' 89' ' ' ILE . 1.7 mp -61.04 -13.7 18.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.369 178.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -66.82 -52.28 45.63 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.47 ' CG ' ' CZ3' ' A' ' 23' ' ' TRP . 0.2 OUTLIER -58.62 -33.63 70.25 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.76 0.79 . . . . 0.0 108.941 177.69 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.997 HD12 ' CB ' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -63.76 -65.91 0.62 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.265 -1.334 . . . . 0.0 111.851 -179.516 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.522 ' HA ' HD23 ' A' ' 75' ' ' LEU . 15.1 t30 -49.77 -23.91 2.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.708 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -85.24 -3.51 58.84 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 33.4 m-70 -150.92 36.49 0.62 Allowed 'General case' 0 CA--C 1.52 -0.188 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.854 HD21 HG22 ' A' ' 82' ' ' VAL . 0.5 OUTLIER -67.46 85.35 0.17 Allowed 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.343 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -68.03 65.75 0.1 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.97 -178.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.94 54.41 21.73 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.463 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.586 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -154.15 28.67 0.72 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.577 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.428 ' HE3' ' HG ' ' A' ' 75' ' ' LEU . 5.1 mmpt? -43.11 -27.35 0.21 Allowed 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 22.8 p80 -57.5 -41.22 80.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.162 0.506 . . . . 0.0 110.514 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.776 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.4 m -58.65 -52.35 66.06 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.156 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.951 HG13 ' CD2' ' A' ' 71' ' ' LEU . 0.2 OUTLIER -57.95 -60.05 2.67 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.529 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.55 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.47 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 60.8 t-80 -42.88 -40.02 2.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.877 0.37 . . . . 0.0 110.485 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -76.28 -49.05 18.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.177 179.143 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 1.066 HD11 HD13 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -75.34 -16.74 15.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.723 -179.231 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.618 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -93.08 -44.1 8.55 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 179.196 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 1.1 mp0 -62.69 -23.94 67.39 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 177.346 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.702 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.3 m-80 -82.73 -59.49 2.49 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 114.491 -1.231 . . . . 0.0 110.07 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 1.071 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -65.07 -49.68 78.24 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.35 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.453 -179.743 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.463 ' N ' HG22 ' A' ' 89' ' ' ILE . 1.3 tptp -58.47 -27.33 64.3 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.494 -0.482 . . . . 0.0 109.941 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -90.7 -4.69 56.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.25 178.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.702 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.0 OUTLIER -78.65 -48.02 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 179.525 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.627 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.2 OUTLIER -48.06 -28.21 2.72 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.456 179.16 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.627 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 34.0 t-80 -62.6 -63.51 1.2 Allowed 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.986 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.542 ' O ' HD21 ' A' ' 5' ' ' LEU . 22.8 m-70 -65.8 -9.17 26.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.182 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 19.3 mt -89.19 -59.87 2.1 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 120.982 0.42 . . . . 0.0 110.149 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.465 ' N ' HD21 ' A' ' 57' ' ' LEU . 87.2 mt-10 -69.0 -12.47 61.71 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.851 178.629 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -85.97 -22.51 27.32 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.625 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.875 HD13 HD23 ' A' ' 5' ' ' LEU . 27.8 tp -75.29 -60.47 2.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.896 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.478 HG22 ' OG ' ' A' ' 53' ' ' SER . 21.6 t -59.88 -41.09 84.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.389 -179.64 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.4 -30.56 70.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.919 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.824 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 CA-C-O 120.435 -0.092 . . . . 0.0 113.024 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.82 -19.78 61.26 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 116.758 0.279 . . . . 0.0 111.193 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 1.041 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -51.93 -23.34 4.85 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.177 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.491 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 16.5 t-20 -65.53 -36.26 83.29 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.766 179.001 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -48.5 -35.79 13.85 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.629 HD13 ' C ' ' A' ' 8' ' ' LEU . 2.4 tm? -88.25 -29.0 20.75 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.093 178.581 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.746 ' HG ' HD21 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -71.83 -27.01 62.62 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 120.825 0.345 . . . . 0.0 110.619 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -58.55 -46.23 87.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.269 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -46.59 -39.03 10.42 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.985 0.422 . . . . 0.0 111.201 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.978 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -58.53 -61.47 2.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.663 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.73 ' N ' HD23 ' A' ' 12' ' ' LEU . 1.8 tt0 -52.19 -34.9 47.45 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.791 -179.338 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.33 -29.7 53.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.889 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.811 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -65.05 -34.52 71.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.834 179.104 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.796 ' CD1' HD13 ' A' ' 19' ' ' LEU . 3.8 mm? -57.13 -36.59 70.88 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.072 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.76 -45.08 4.66 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.127 0.489 . . . . 0.0 110.329 179.075 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.485 ' HB3' HG23 ' A' ' 81' ' ' THR . 59.3 m-80 -67.32 -44.42 79.19 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.324 178.574 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.879 HD12 HD22 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -52.82 -35.6 57.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.065 179.791 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.908 ' CE1' HD12 ' A' ' 30' ' ' LEU . 26.7 m-70 -55.18 -31.66 61.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.641 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.495 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 6.4 mmpt? -94.38 -4.59 48.18 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -178.01 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.598 ' HB2' HG21 ' A' ' 81' ' ' THR . 3.5 m-80 -128.06 -13.82 5.04 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.028 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.974 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.65 -38.47 84.96 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.573 -179.916 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.495 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 33.3 t60 -175.2 -48.66 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.861 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 143.28 126.6 2.04 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.409 -0.9 . . . . 0.0 112.819 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 88.02 100.13 0.92 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.316 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.38 -26.03 4.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.717 0.294 . . . . 0.0 110.566 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -55.63 -30.02 60.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.507 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -86.97 -35.19 19.0 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.436 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.974 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.2 tm? -71.86 -32.87 67.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.874 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -50.38 -36.24 31.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.846 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.72 -25.96 54.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.551 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.862 ' O ' HG22 ' A' ' 67' ' ' VAL . 2.8 p -89.8 -48.84 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.26 -179.577 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.57 ' HB2' HD11 ' A' ' 30' ' ' LEU . 2.3 t70 -69.08 -23.75 64.06 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -54.05 -36.14 62.76 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.186 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.769 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -62.85 -33.52 75.43 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.309 178.385 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.859 HD11 HD21 ' A' ' 12' ' ' LEU . 0.1 OUTLIER -74.51 -64.25 1.07 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.24 179.184 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.72 ' O ' HG22 ' A' ' 41' ' ' ILE . 3.3 tt0 -46.23 -31.54 2.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.39 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.43 -28.51 59.38 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.919 0.39 . . . . 0.0 110.376 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.769 HG23 ' O ' ' A' ' 36' ' ' HIS . 53.3 t -73.4 -46.42 49.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.659 179.537 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.72 HG22 ' O ' ' A' ' 38' ' ' GLN . 2.7 tp -45.47 -34.72 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.386 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.459 ' O ' ' HB2' ' A' ' 46' ' ' ASP . 1.4 mt-10 -75.65 -30.95 59.62 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.646 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.528 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -82.8 -25.69 32.48 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.875 178.754 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.581 HG21 HD11 ' A' ' 9' ' ' LEU . 31.0 mm -87.29 -47.53 15.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.678 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.563 ' CE1' ' OD1' ' A' ' 46' ' ' ASP . 0.1 OUTLIER -70.97 -26.9 63.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.865 -178.957 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.563 ' OD1' ' CE1' ' A' ' 45' ' ' HIS . 69.3 m-20 -86.65 -40.72 14.84 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.07 0.462 . . . . 0.0 110.302 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.528 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 4.3 m-85 -72.3 -40.94 67.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.216 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.473 ' HE3' ' HA ' ' A' ' 45' ' ' HIS . 16.7 ptp -53.29 -26.9 20.23 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.817 0.341 . . . . 0.0 111.072 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -79.71 -1.4 38.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.436 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 120.04 18.38 4.27 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.863 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.403 ' O ' ' CD2' ' A' ' 47' ' ' PHE . . . -95.97 28.1 13.99 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.453 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.27 38.98 3.86 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.448 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.1 p -62.45 -25.68 68.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.773 0.321 . . . . 0.0 111.182 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.42 70.92 3.01 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.531 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.413 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . 150.19 -20.86 1.09 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.798 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.478 ' O ' ' CB ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.44 -46.0 9.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.618 0.246 . . . . 0.0 111.473 -179.814 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.631 HD21 ' HB3' ' A' ' 96' ' ' LEU . 13.7 tp -62.6 -9.28 8.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.301 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 61' ' ' MET . 16.9 pt20 -86.2 -50.83 6.69 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.815 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 17.4 mm-40 -87.66 -28.31 21.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.951 0.405 . . . . 0.0 110.302 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.592 ' CG ' HG13 ' A' ' 40' ' ' VAL . 9.3 tpp -78.23 -33.15 50.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.042 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.554 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 3.8 ptt? -55.44 -38.99 69.73 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.547 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 66' ' ' GLN . 0.3 OUTLIER -65.62 -15.57 62.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.898 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.491 ' HB3' HG21 ' A' ' 40' ' ' VAL . 75.0 tt0 -79.32 -25.4 42.35 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.732 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.555 ' HA ' HD22 ' A' ' 37' ' ' LEU . 2.0 p90 -86.95 -35.39 18.91 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.903 0.382 . . . . 0.0 110.467 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.478 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 0.0 OUTLIER -74.47 -31.2 62.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.545 179.294 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 62' ' ' LYS . 11.6 tt0 -57.91 -33.99 69.35 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.505 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.862 HG22 ' O ' ' A' ' 33' ' ' VAL . 72.0 t -58.09 -47.09 87.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.079 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 1.022 HD11 HD13 ' A' ' 89' ' ' ILE . 1.3 mp -65.31 -14.68 61.33 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.269 178.685 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -66.37 -62.02 1.69 Allowed 'General case' 0 C--O 1.231 0.094 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HB3' HG21 ' A' ' 33' ' ' VAL . 14.4 tp10 -50.82 -32.1 19.1 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.787 0.804 . . . . 0.0 109.314 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.879 HD22 HD12 ' A' ' 19' ' ' LEU . 0.4 OUTLIER -74.52 -69.41 0.46 Allowed 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 113.979 -1.464 . . . . 0.0 112.232 -178.939 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.411 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 1.5 t-20 -49.49 -26.3 3.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.702 -179.203 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.64 6.26 28.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.557 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.593 ' O ' ' N ' ' A' ' 76' ' ' GLN . 66.6 m-70 -152.15 32.71 0.53 Allowed 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.746 HD21 HG21 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -54.65 83.28 0.0 OUTLIER 'General case' 0 CA--C 1.521 -0.135 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.789 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.593 ' N ' ' O ' ' A' ' 74' ' ' HIS . 1.0 OUTLIER -83.9 -34.07 24.62 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.947 -177.425 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -83.85 -66.45 1.49 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.615 -0.802 . . . . 0.0 113.062 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -174.35 116.88 0.6 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.115 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.57 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -44.28 -29.78 0.71 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.634 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -45.58 -30.81 1.6 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.838 0.352 . . . . 0.0 111.032 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.598 HG21 ' HB2' ' A' ' 22' ' ' ASN . 1.2 m -69.93 -74.4 0.14 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.851 HG13 HD21 ' A' ' 71' ' ' LEU . 22.2 t -48.92 -40.88 12.8 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.384 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.034 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.471 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -48.97 -41.31 33.78 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.089 0.471 . . . . 0.0 109.737 179.541 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.433 ' O ' ' HB3' ' A' ' 88' ' ' ASN . 0.6 OUTLIER -76.25 -27.58 56.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.696 178.865 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.997 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.61 -36.16 10.48 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.165 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.151 -179.611 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.471 ' CG ' ' HA ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -71.93 -43.68 64.88 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.213 -0.292 . . . . 0.0 110.213 179.433 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -62.41 -29.46 70.51 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.299 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.715 ' OD1' HG11 ' A' ' 15' ' ' VAL . 0.1 OUTLIER -82.92 -57.3 3.35 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.305 179.122 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 1.022 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -61.56 -48.23 89.73 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.374 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.97 -179.616 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.454 ' N ' HG22 ' A' ' 89' ' ' ILE . 20.6 tptp -61.46 -28.57 69.38 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 120.291 -0.564 . . . . 0.0 109.494 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -90.73 -2.24 57.82 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.094 178.287 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.7 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.0 OUTLIER -78.62 -43.27 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.355 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.637 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -54.97 -26.64 37.98 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.149 178.692 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.637 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.1 OUTLIER -62.87 -65.73 0.64 Allowed 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.84 -179.523 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.576 ' HB3' HD11 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -60.15 -12.1 7.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.108 178.378 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.746 HD21 ' HG ' ' A' ' 9' ' ' LEU . 55.5 mt -89.29 -65.7 0.99 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.529 179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.466 ' HA ' HD23 ' A' ' 57' ' ' LEU . 4.2 mm-40 -63.09 -16.36 59.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.17 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 94' ' ' HIS . 56.6 tt0 -87.83 -10.73 49.95 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.745 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 1.041 HD13 HD23 ' A' ' 5' ' ' LEU . 30.0 tp -81.4 -57.18 3.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.644 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 41.1 t -62.35 -31.13 50.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.276 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -69.4 -40.61 77.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.919 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.293 -0.861 . . . . 0.0 110.921 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 N-CA-C 112.488 -0.245 . . . . 0.0 112.488 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 tptm -59.96 -17.44 38.09 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 116.611 0.205 . . . . 0.0 110.928 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.744 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -49.27 -25.56 2.43 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.111 -0.699 . . . . 0.0 109.111 178.041 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -59.29 -41.2 88.39 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.832 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -50.42 -31.45 15.04 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.204 0.526 . . . . 0.0 110.001 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.669 ' O ' HD13 ' A' ' 8' ' ' LEU . 2.8 tm? -83.49 -30.61 27.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.024 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.668 ' HB3' HD11 ' A' ' 41' ' ' ILE . 8.8 mt -60.79 -42.78 98.25 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.555 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -45.5 -40.05 8.05 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.487 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.421 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 5.4 m-20 -54.65 -43.02 72.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.987 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.972 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -56.57 -63.36 1.22 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.534 179.805 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.775 ' HA ' HD23 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -52.41 -37.77 57.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.314 -179.14 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -75.18 -26.73 59.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.941 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.892 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -68.89 -28.52 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.09 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 1.015 HD12 HD13 ' A' ' 19' ' ' LEU . 1.6 mm? -67.48 -34.63 77.55 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.312 179.105 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 ttpp -40.45 -33.94 0.3 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.151 0.501 . . . . 0.0 110.515 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.888 ' HB3' HG23 ' A' ' 81' ' ' THR . 2.2 m-20 -81.18 -41.53 22.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.905 178.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 1.015 HD13 HD12 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -51.72 -29.93 20.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.128 179.722 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.972 ' CE1' HD12 ' A' ' 30' ' ' LEU . 76.2 m-70 -62.19 -37.51 85.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.021 0.439 . . . . 0.0 110.836 -179.753 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.545 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 4.3 mmpt? -94.5 16.85 14.29 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.034 -178.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.497 ' HB2' HG21 ' A' ' 81' ' ' THR . 7.6 m-80 -145.41 -20.12 0.48 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -179.031 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.967 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -63.75 -27.66 69.35 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 119.719 -0.793 . . . . 0.0 110.959 -179.608 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.46 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 86.2 t60 -178.86 -53.13 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.889 0.376 . . . . 0.0 110.643 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 141.68 126.83 2.2 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.874 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 90.9 94.63 1.26 Allowed Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.107 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.82 -26.65 1.72 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.753 0.311 . . . . 0.0 110.591 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -53.8 -32.25 51.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.484 179.164 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -86.25 -42.37 13.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.329 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.972 HD12 ' CE1' ' A' ' 20' ' ' HIS . 1.5 tm? -62.05 -35.89 79.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.838 179.076 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.468 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 45.3 t60 -46.61 -35.35 5.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.404 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.61 -24.1 53.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.689 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.892 ' O ' HG22 ' A' ' 67' ' ' VAL . 2.7 p -91.87 -47.17 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.438 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.662 ' HB2' HD11 ' A' ' 30' ' ' LEU . 6.7 t70 -71.63 -23.98 61.79 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.086 179.165 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.468 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 11.3 t30 -54.33 -30.69 52.18 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.188 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.741 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -69.0 -32.21 71.6 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.851 178.569 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.821 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -75.39 -64.52 1.05 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.434 179.427 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.747 ' O ' HG22 ' A' ' 41' ' ' ILE . 1.5 pt20 -47.08 -28.53 1.76 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.298 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -76.33 -28.36 56.87 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.91 0.386 . . . . 0.0 110.351 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.741 HG23 ' O ' ' A' ' 36' ' ' HIS . 78.6 t -75.92 -43.3 39.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.504 179.337 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.747 HG22 ' O ' ' A' ' 38' ' ' GLN . 4.7 tp -46.5 -33.11 1.84 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.13 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.056 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -75.57 -30.59 59.72 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.081 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.597 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 43.2 m-20 -82.79 -25.41 32.76 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.835 178.564 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.789 HD13 ' HE2' ' A' ' 56' ' ' LYS . 17.1 mm -86.9 -53.05 10.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.098 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -64.58 -27.71 69.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.23 -179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -86.63 -46.8 9.75 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 120.907 0.384 . . . . 0.0 110.501 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.597 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.5 m-30 -66.5 -23.24 66.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.567 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.407 ' HE3' HD22 ' A' ' 96' ' ' LEU . 0.0 OUTLIER -52.8 -26.01 13.11 Favored 'General case' 0 C--N 1.334 -0.109 0 CA-C-O 120.888 0.375 . . . . 0.0 110.635 179.427 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -90.9 9.45 30.36 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.367 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.58 -2.15 58.75 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.694 -0.765 . . . . 0.0 113.082 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.36 -41.28 31.84 Favored Glycine 0 C--N 1.333 0.39 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.167 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.442 ' HA3' ' CE2' ' A' ' 47' ' ' PHE . . . -163.74 24.73 0.19 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.178 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.59 -168.32 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.883 0.373 . . . . 0.0 110.764 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.651 ' H ' HG11 ' A' ' 100' ' ' VAL . . . 88.65 -62.02 3.76 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.77 -0.728 . . . . 0.0 113.041 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.434 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . -124.57 11.55 7.96 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.386 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.789 ' HE2' HD13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -88.43 -44.23 10.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 117.034 0.417 . . . . 0.0 111.249 179.858 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.72 HD22 ' NZ ' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -59.32 -14.09 10.32 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.872 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 55' ' ' GLY . 27.1 pt20 -85.9 -50.62 6.96 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.34 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -85.87 -29.81 23.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.864 0.364 . . . . 0.0 110.655 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.645 ' HG2' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -78.3 -31.78 49.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.995 179.796 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.517 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 0.1 OUTLIER -56.86 -40.47 76.21 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.489 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.97 -19.44 61.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.929 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.536 ' HB3' HG21 ' A' ' 40' ' ' VAL . 18.7 tt0 -76.46 -31.86 58.06 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.543 -179.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.577 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.1 p90 -87.04 -25.86 24.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.88 0.371 . . . . 0.0 110.456 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -82.13 -30.96 30.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.417 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -58.48 -36.7 74.14 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.416 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.892 HG22 ' O ' ' A' ' 33' ' ' VAL . 83.4 t -54.19 -42.89 58.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.422 179.141 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 1.096 HD21 HG13 ' A' ' 85' ' ' ILE . 0.5 OUTLIER -74.09 -14.28 60.96 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.512 179.142 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.67 -52.19 53.53 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.417 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 5.5 tp10 -57.65 -24.57 57.26 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.528 0.68 . . . . 0.0 109.709 178.364 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 1.019 HD23 HG22 ' A' ' 82' ' ' VAL . 0.9 OUTLIER -70.45 -65.27 0.75 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.734 -1.121 . . . . 0.0 112.818 -178.826 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -46.53 -21.7 0.21 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.418 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.407 ' N ' ' C ' ' A' ' 71' ' ' LEU . 45.7 m-20 -83.56 -23.85 31.84 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.135 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.53 ' CB ' ' O ' ' A' ' 23' ' ' TRP . 44.1 m-70 -135.94 33.2 2.91 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 119.234 -0.986 . . . . 0.0 112.993 -179.257 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.64 ' CD2' HG21 ' A' ' 82' ' ' VAL . 0.0 OUTLIER -51.92 92.08 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 177.587 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.484 ' N ' ' O ' ' A' ' 74' ' ' HIS . 41.9 tp60 -64.3 69.14 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.55 -178.017 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 52.74 25.49 22.4 Favored Glycine 0 N--CA 1.453 -0.176 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.716 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -126.7 40.01 1.87 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.426 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.439 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -48.9 -31.47 7.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.638 0.256 . . . . 0.0 111.215 -179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -58.25 -31.72 67.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.042 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.888 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -68.02 -74.56 0.12 Allowed 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 1.019 HG22 HD23 ' A' ' 71' ' ' LEU . 12.6 t -49.09 -40.93 13.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.95 179.594 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.48 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 7.0 m170 -49.33 -41.86 39.86 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.189 0.519 . . . . 0.0 109.776 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -76.27 -27.07 56.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.622 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 1.096 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.25 -36.34 10.94 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.9 -179.865 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -71.11 -45.82 62.89 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.164 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.459 ' NE2' ' OE2' ' A' ' 86' ' ' GLU . 1.2 mp0 -59.04 -29.74 67.52 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.732 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.8 m-80 -82.96 -67.61 0.77 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.505 179.147 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.972 ' CG1' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -52.84 -47.83 51.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.511 -179.591 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.427 ' N ' HG22 ' A' ' 89' ' ' ILE . 0.1 OUTLIER -62.3 -29.26 70.31 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.28 -0.568 . . . . 0.0 109.662 179.647 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -90.78 -4.0 56.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.168 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.732 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -78.58 -44.59 25.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.628 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -52.39 -29.19 22.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.536 179.149 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.628 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 38.1 t-80 -61.57 -65.36 0.7 Allowed 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.109 -179.262 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.433 ' HB3' HD11 ' A' ' 5' ' ' LEU . 40.9 m170 -62.44 -9.56 8.82 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.369 178.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.503 HD11 HD21 ' A' ' 9' ' ' LEU . 30.9 mt -89.3 -63.46 1.29 Allowed 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 120.956 0.408 . . . . 0.0 110.456 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -67.56 -12.25 59.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.219 179.113 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 94' ' ' HIS . 11.2 mm-40 -87.92 -26.42 22.72 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 120.912 0.386 . . . . 0.0 110.377 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.744 HD13 HD23 ' A' ' 5' ' ' LEU . 11.3 tp -66.83 -56.84 8.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.92 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.651 HG11 ' H ' ' A' ' 54' ' ' GLY . 31.9 t -63.56 -39.94 87.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.423 -179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -60.9 -33.04 72.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.837 0.351 . . . . 0.0 111.006 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.838 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 112.84 -0.104 . . . . 0.0 112.84 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -63.2 -17.63 62.62 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.61 0.205 . . . . 0.0 111.105 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.803 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -51.17 -24.02 3.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.046 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.412 ' N ' ' CE ' ' A' ' 48' ' ' MET . 33.6 p-10 -59.61 -41.13 89.66 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.896 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -48.24 -32.59 7.4 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.22 0.533 . . . . 0.0 110.048 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.618 ' C ' HD13 ' A' ' 8' ' ' LEU . 2.5 tm? -87.4 -30.3 20.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.295 179.314 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.835 ' HG ' HD21 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -68.92 -34.94 76.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.359 179.799 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -52.96 -43.06 66.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.302 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.41 -41.31 28.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.927 0.394 . . . . 0.0 111.001 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.007 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -57.36 -61.22 2.63 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.6 179.833 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.724 ' H ' HD23 ' A' ' 12' ' ' LEU . 7.5 tm0? -51.28 -38.04 50.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.047 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -75.67 -28.47 58.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.905 179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.818 HG13 ' HB ' ' A' ' 85' ' ' ILE . 0.3 OUTLIER -68.18 -31.08 50.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.983 179.19 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.759 ' CD1' HD13 ' A' ' 19' ' ' LEU . 3.4 mm? -60.5 -37.38 80.92 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.207 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.2 ttpt -41.78 -41.91 2.48 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.033 0.444 . . . . 0.0 110.554 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.752 ' HB3' HG23 ' A' ' 81' ' ' THR . 0.8 OUTLIER -70.9 -43.77 67.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.759 178.729 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.887 HD12 HD22 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -50.42 -44.0 55.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.572 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 1.058 ' CE1' HD12 ' A' ' 30' ' ' LEU . 78.5 m-70 -49.33 -31.3 8.96 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.502 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 6.2 mmpt? -94.24 -9.86 34.79 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -177.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.634 ' HB2' HG21 ' A' ' 81' ' ' THR . 4.8 m120 -126.37 3.82 6.99 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -179.523 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.779 ' CB ' HD12 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -77.06 -54.05 7.03 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.752 179.833 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.524 ' HB3' ' CZ2' ' A' ' 23' ' ' TRP . 8.7 t-160 179.39 57.6 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.921 0.391 . . . . 0.0 111.027 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 118.21 -107.5 1.48 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.302 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -124.65 -146.2 6.81 Favored Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.167 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.454 ' CD ' ' CE1' ' A' ' 20' ' ' HIS . 17.3 ttpp -94.11 -11.13 31.18 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -50.41 -65.45 0.56 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -178.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -75.14 -25.39 58.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.567 0.222 . . . . 0.0 111.111 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.058 HD12 ' CE1' ' A' ' 20' ' ' HIS . 2.0 tm? -72.99 -29.15 62.82 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.432 ' N ' ' O ' ' A' ' 27' ' ' LYS . 10.2 t-80 -47.71 -51.85 20.51 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.527 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.11 -22.48 66.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.887 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.955 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.2 t -85.82 -62.25 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.864 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.591 ' H ' HD13 ' A' ' 30' ' ' LEU . 1.3 t0 -59.42 -25.26 64.18 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -56.41 -39.42 72.99 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 177.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.736 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -65.13 -45.85 83.39 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 177.444 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.965 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -53.51 -69.69 0.11 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.619 178.623 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.855 ' O ' HG22 ' A' ' 41' ' ' ILE . 1.6 mt-30 -46.48 -43.55 16.79 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.038 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -54.99 -26.22 35.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.05 0.452 . . . . 0.0 110.243 179.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.736 HG23 ' O ' ' A' ' 36' ' ' HIS . 32.5 t -74.36 -57.52 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.374 179.274 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.855 HG22 ' O ' ' A' ' 38' ' ' GLN . 0.5 OUTLIER -44.49 -35.71 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.79 -179.766 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.428 ' HA ' ' ND1' ' A' ' 45' ' ' HIS . 3.8 pt-20 -75.64 -30.29 59.41 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.829 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.517 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 2.1 m-20 -84.08 -27.56 28.17 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.885 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.584 HG22 ' SD ' ' A' ' 48' ' ' MET . 25.3 mm -86.99 -48.43 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.497 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.428 ' ND1' ' HA ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -68.96 -26.83 65.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.276 -179.631 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -86.48 -41.91 14.0 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.071 0.463 . . . . 0.0 110.226 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.517 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.4 m-85 -72.14 -23.72 61.34 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.606 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.584 ' SD ' HG22 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -54.01 -34.6 60.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.981 179.752 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -73.77 -22.46 59.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.422 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 146.14 -11.8 1.61 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.428 -0.892 . . . . 0.0 113.082 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.36 -26.44 4.97 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.71 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 154.03 44.61 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.256 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.661 ' OG ' HG22 ' A' ' 100' ' ' VAL . 1.8 t -59.53 -29.65 68.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.731 0.3 . . . . 0.0 111.03 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.23 72.03 2.05 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.191 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.464 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . 149.03 -19.79 1.23 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.575 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.492 ' CD ' HD13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -88.64 -46.01 9.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.663 0.268 . . . . 0.0 111.279 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.795 HD11 ' HB3' ' A' ' 96' ' ' LEU . 5.7 tp -61.79 -10.84 9.95 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.464 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 1.6 pp0? -85.88 -50.98 6.69 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.939 179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -86.88 -30.8 21.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.997 0.427 . . . . 0.0 110.382 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.729 ' HG3' HG13 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -76.39 -29.52 57.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.616 179.637 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.508 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 2.9 tmm? -55.66 -44.69 77.47 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 121.015 0.436 . . . . 0.0 110.509 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -12.82 60.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.181 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.42 ' HB3' HG22 ' A' ' 40' ' ' VAL . 28.2 tt0 -83.2 -24.75 32.28 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.535 -179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.491 ' HB3' HG11 ' A' ' 40' ' ' VAL . 1.6 p90 -87.08 -35.38 18.74 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.902 0.382 . . . . 0.0 110.427 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.458 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 0.0 OUTLIER -79.17 -30.97 43.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.96 179.757 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -58.92 -34.93 72.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.019 0.438 . . . . 0.0 110.407 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.965 HG21 ' HB2' ' A' ' 37' ' ' LEU . 80.5 t -57.65 -44.05 84.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.418 179.417 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 1.033 HD11 HD13 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.44 -9.21 55.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.611 178.799 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -71.45 -57.99 3.92 Favored 'General case' 0 C--O 1.231 0.098 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.589 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 3.5 tp10 -53.38 -37.48 62.47 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.949 0.88 . . . . 0.0 108.996 177.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.887 HD22 HD12 ' A' ' 19' ' ' LEU . 0.3 OUTLIER -70.86 -68.34 0.44 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.72 -1.582 . . . . 0.0 112.04 -179.32 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.411 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 22.5 t30 -49.3 -25.59 2.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.924 -179.348 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -85.28 4.17 36.15 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.656 ' O ' ' N ' ' A' ' 76' ' ' GLN . 72.2 m-70 -150.9 32.03 0.62 Allowed 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.597 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -50.27 82.76 0.0 OUTLIER 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.912 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.656 ' N ' ' O ' ' A' ' 74' ' ' HIS . 5.4 tt0 -84.18 -34.32 24.0 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.675 -177.512 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -88.1 -20.34 49.91 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.7 -0.762 . . . . 0.0 113.009 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.512 ' C ' HD12 ' A' ' 75' ' ' LEU . . . 130.82 130.24 3.16 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.256 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.597 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -52.76 -19.44 2.45 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -179.824 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -48.6 -39.24 23.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.696 0.284 . . . . 0.0 111.32 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.752 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -69.55 -74.15 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 178.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.872 HG13 HD21 ' A' ' 71' ' ' LEU . 25.8 t -47.77 -36.8 5.5 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.414 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.084 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.474 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 57.0 t-80 -52.45 -41.08 62.97 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -76.17 -28.26 57.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.459 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.987 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.61 -33.15 7.45 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.196 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.054 -179.728 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.575 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -75.95 -44.69 38.74 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.059 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -60.85 -29.97 69.84 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.053 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.716 ' O ' HD13 ' A' ' 92' ' ' ILE . 2.0 m-80 -82.89 -63.19 1.41 Allowed 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.065 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 1.033 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -54.5 -48.51 69.79 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.186 179.959 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.45 ' N ' HG22 ' A' ' 89' ' ' ILE . 0.1 OUTLIER -60.88 -29.55 69.62 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.6 179.658 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -90.8 -3.44 57.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.371 178.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.716 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -78.65 -39.05 22.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.62 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -60.45 -25.07 65.72 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.25 178.689 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.62 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 8.9 t-80 -60.56 -65.91 0.61 Allowed 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.222 -179.109 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.601 ' HB3' HD11 ' A' ' 5' ' ' LEU . 63.7 m80 -63.67 -9.32 13.36 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.48 178.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.835 HD21 ' HG ' ' A' ' 9' ' ' LEU . 55.2 mt -89.48 -59.7 2.14 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.127 0.489 . . . . 0.0 110.543 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.422 ' HA ' ' CD2' ' A' ' 57' ' ' LEU . 5.4 mt-10 -66.61 -11.96 55.83 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.382 179.011 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.533 ' HB2' ' O ' ' A' ' 94' ' ' HIS . 8.8 tt0 -94.68 3.71 54.73 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.723 0.297 . . . . 0.0 111.111 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.803 HD13 HD23 ' A' ' 5' ' ' LEU . 8.1 tp -101.66 -47.48 4.62 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.966 0.412 . . . . 0.0 110.669 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.661 HG22 ' OG ' ' A' ' 53' ' ' SER . 41.2 t -76.89 -34.12 22.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.124 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -98.33 31.33 2.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.943 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.6 tpt85 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.958 179.98 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.518 ' HA2' ' HG3' ' A' ' 48' ' ' MET . . . . . . . . 0 N--CA 1.451 -0.301 0 CA-C-O 120.397 -0.113 . . . . 0.0 112.99 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.45 -18.62 61.68 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 116.654 0.227 . . . . 0.0 111.056 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.891 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -53.14 -21.76 5.42 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.061 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.595 ' HA ' HD12 ' A' ' 9' ' ' LEU . 38.5 p-10 -61.39 -40.18 93.4 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.815 179.176 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -51.38 -28.44 12.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.086 0.469 . . . . 0.0 110.012 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.814 ' O ' HD22 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -83.86 -29.38 27.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.002 179.22 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.813 ' O ' HD23 ' A' ' 12' ' ' LEU . 10.3 mt -63.79 -30.61 71.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.049 0.452 . . . . 0.0 110.792 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -54.46 -51.28 65.52 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.549 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -51.25 -49.55 60.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.885 0.374 . . . . 0.0 111.33 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.044 HD21 HD11 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -56.51 -60.82 2.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.615 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.615 ' HA ' HD23 ' A' ' 16' ' ' LEU . 2.4 tt0 -53.85 -35.28 61.31 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.037 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -77.98 -26.03 48.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.228 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.848 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -70.5 -27.56 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.401 179.314 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.676 HD12 HD22 ' A' ' 19' ' ' LEU . 3.0 mm? -61.1 -36.66 80.28 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.313 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.562 ' HA ' ' CD2' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -48.68 -40.54 28.52 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.105 0.479 . . . . 0.0 110.096 179.478 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.92 -39.17 76.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.515 178.552 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.909 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -55.74 -53.53 55.45 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.842 -179.662 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.59 ' CA ' ' HG ' ' A' ' 30' ' ' LEU . 2.2 p80 -53.93 -15.44 1.37 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -178.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.626 ' HA ' ' CE ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -92.85 -24.12 18.59 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.674 -179.815 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.552 ' HB2' HG21 ' A' ' 81' ' ' THR . 3.4 m-80 -130.8 28.71 4.82 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.832 0.349 . . . . 0.0 111.061 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.901 ' CB ' HD12 ' A' ' 71' ' ' LEU . 2.4 p-90 -88.99 -31.84 17.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.739 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.506 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 79.7 t60 -177.9 -52.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.652 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 168.04 120.19 0.51 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.568 -0.825 . . . . 0.0 113.105 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 61.97 128.51 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.838 179.499 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.439 ' HD2' ' CD2' ' A' ' 20' ' ' HIS . 7.6 tttt -64.11 -16.26 61.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.597 0.237 . . . . 0.0 110.917 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -44.94 -48.98 11.34 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.483 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -77.44 -39.45 46.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.482 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.809 ' O ' HD13 ' A' ' 30' ' ' LEU . 1.8 tm? -59.81 -28.2 67.25 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.425 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 1.4 t60 -46.39 -58.73 3.47 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.306 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.43 -21.88 60.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.746 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.863 ' CG1' HG13 ' A' ' 67' ' ' VAL . 2.2 t -83.41 -65.26 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.846 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.635 ' H ' HD13 ' A' ' 30' ' ' LEU . 1.3 t0 -61.37 -25.03 66.89 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.369 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.425 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 16.2 t-20 -58.77 -41.15 85.92 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 177.55 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.734 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -64.72 -46.95 80.09 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 177.171 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.97 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -51.44 -68.48 0.17 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.945 178.521 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.404 ' HG3' ' N ' ' A' ' 39' ' ' ASN . 9.0 pt20 -46.66 -41.77 15.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.133 -179.647 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.404 ' N ' ' HG3' ' A' ' 38' ' ' GLN . 1.5 t-20 -59.25 -26.54 64.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.24 179.419 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.772 HG12 ' CD1' ' A' ' 44' ' ' ILE . 14.9 t -70.92 -52.89 24.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.404 179.427 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 1.044 HD11 HD21 ' A' ' 12' ' ' LEU . 1.8 mp -46.07 -38.64 3.13 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.535 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.412 ' HA ' ' ND1' ' A' ' 45' ' ' HIS . 1.5 pt-20 -72.91 -28.74 62.65 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 120.747 0.308 . . . . 0.0 110.802 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.555 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 6.0 m-20 -84.14 -28.31 27.53 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.772 ' CD1' HG12 ' A' ' 40' ' ' VAL . 34.3 mt -86.56 -52.48 11.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.335 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.425 ' HB2' ' CB ' ' A' ' 6' ' ' ASN . 0.1 OUTLIER -63.27 -26.76 68.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.727 -179.943 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -86.68 -36.68 18.59 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.026 0.441 . . . . 0.0 110.01 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.555 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.2 m-85 -74.22 -42.1 60.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.28 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.518 ' HG3' ' HA2' ' A' ' 3' ' ' GLY . 12.1 ptp -51.73 -24.09 5.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.331 -179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -88.71 9.29 24.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.516 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 111.27 20.36 7.1 Favored Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.991 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.407 ' CA ' ' HA ' ' A' ' 47' ' ' PHE . . . -96.45 26.95 19.3 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.706 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.87 29.82 7.08 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.608 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.641 ' O ' HG11 ' A' ' 100' ' ' VAL . 0.2 OUTLIER -66.31 -12.92 59.37 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.514 0.19 . . . . 0.0 111.514 -179.9 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.455 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -83.16 71.63 2.98 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.668 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.414 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . 131.1 -9.45 5.68 Favored Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.803 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.497 ' HE3' ' CG ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -88.51 -34.38 17.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.668 0.27 . . . . 0.0 111.295 -179.749 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.594 HD21 HG23 ' A' ' 44' ' ' ILE . 0.1 OUTLIER -65.51 -11.58 44.77 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -179.197 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.414 ' HG2' ' O ' ' A' ' 55' ' ' GLY . 15.1 pt20 -86.47 -50.03 7.17 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.547 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 71.4 mt-10 -85.54 -31.02 22.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.835 0.35 . . . . 0.0 110.783 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.661 ' HG3' HG13 ' A' ' 40' ' ' VAL . 0.8 OUTLIER -78.11 -33.09 50.75 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.902 179.768 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.511 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 4.5 tmm? -55.37 -39.17 69.77 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.562 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.84 -17.27 62.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.967 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.95 -31.36 45.05 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.559 ' HA ' HD22 ' A' ' 37' ' ' LEU . 0.8 OUTLIER -87.27 -24.49 24.34 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.192 0.52 . . . . 0.0 109.597 179.351 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -83.02 -33.39 26.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.164 178.345 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -55.48 -38.44 69.12 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.904 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.97 HG21 ' HB2' ' A' ' 37' ' ' LEU . 3.9 t -51.57 -44.39 33.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.109 0.48 . . . . 0.0 110.285 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.884 HD21 HG13 ' A' ' 85' ' ' ILE . 0.9 OUTLIER -68.4 -6.71 26.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.003 179.302 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -75.85 -59.89 2.56 Favored 'General case' 0 C--N 1.338 0.092 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.468 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -48.44 -40.7 27.04 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 122.391 1.091 . . . . 0.0 108.564 177.447 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.909 HD13 ' CG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -70.74 -68.12 0.45 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 112.904 -1.953 . . . . 0.0 112.029 -179.421 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -51.15 -26.08 6.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.346 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -87.91 9.21 22.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.265 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.491 ' O ' ' N ' ' A' ' 76' ' ' GLN . 14.2 m-70 -158.68 35.63 0.22 Allowed 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.633 HD11 HG23 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -54.67 88.44 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.198 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 74' ' ' HIS . 3.6 tp60 -63.76 69.25 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.384 -178.226 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 57.11 30.68 61.0 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.401 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.428 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -130.62 39.12 1.84 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.587 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.462 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -49.47 -32.03 11.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.697 0.284 . . . . 0.0 111.26 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -63.18 -31.53 72.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.135 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.552 HG21 ' HB2' ' A' ' 22' ' ' ASN . 1.9 m -67.49 -72.57 0.16 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.908 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.808 ' CG1' HD21 ' A' ' 71' ' ' LEU . 42.9 t -51.48 -39.1 21.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.852 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.48 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.7 OUTLIER -46.6 -41.23 14.21 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 179.226 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -76.27 -29.73 57.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.729 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.884 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.38 -30.44 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.106 -179.675 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.3 OUTLIER -79.76 -46.51 16.86 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.929 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.428 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 1.7 mp0 -59.59 -27.51 66.34 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 177.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.529 ' O ' HD12 ' A' ' 92' ' ' ILE . 2.4 m120 -82.71 -69.17 0.65 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.811 178.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.949 ' CG1' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -49.84 -39.39 15.01 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.445 -179.964 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.504 ' O ' ' CD2' ' A' ' 93' ' ' PHE . 28.5 mmmt -63.54 -23.55 67.43 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 119.89 -0.724 . . . . 0.0 110.002 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -90.54 -8.75 49.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.177 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.835 HD13 ' HA ' ' A' ' 89' ' ' ILE . 1.2 mp -78.75 -56.31 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.977 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.504 ' CD2' ' O ' ' A' ' 90' ' ' LYS . 0.6 OUTLIER -45.72 -44.56 13.75 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.726 179.669 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.485 ' N ' ' CG ' ' A' ' 93' ' ' PHE . 9.3 t-160 -57.52 -61.43 2.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.789 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -61.54 -11.97 13.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.502 178.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 18.7 mt -89.18 -65.55 1.01 Allowed 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.972 0.415 . . . . 0.0 110.599 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -65.71 -13.31 59.03 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.114 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.478 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 4.4 tp10 -87.07 -26.94 23.44 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-O 120.938 0.399 . . . . 0.0 110.306 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.891 HD13 HD23 ' A' ' 5' ' ' LEU . 18.8 tp -66.19 -57.74 6.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.634 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.641 HG11 ' O ' ' A' ' 53' ' ' SER . 33.5 t -64.15 -37.66 80.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.21 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -60.91 -43.15 98.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.896 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.852 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.571 ' HA2' ' HG3' ' A' ' 48' ' ' MET . . . . . . . . 0 N--CA 1.452 -0.298 0 N-CA-C 112.726 -0.15 . . . . 0.0 112.726 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.4 tptm -63.85 -17.43 63.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.481 0.181 . . . . 0.0 111.044 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.927 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -52.38 -22.9 5.12 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.198 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.459 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 26.3 p-10 -56.95 -46.38 82.16 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.02 179.266 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -49.43 -32.16 11.2 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.089 0.471 . . . . 0.0 110.209 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.608 ' C ' HD13 ' A' ' 8' ' ' LEU . 1.7 tm? -87.85 -26.65 22.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.384 179.246 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.826 HD22 HD12 ' A' ' 41' ' ' ILE . 1.0 OUTLIER -74.41 -40.94 61.68 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.748 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -49.3 -42.05 40.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.638 -179.725 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -50.41 -42.32 53.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.129 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.976 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -59.57 -62.53 1.81 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.678 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.731 ' H ' HD23 ' A' ' 12' ' ' LEU . 4.0 tt0 -51.17 -35.45 36.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.977 -179.339 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -77.39 -30.92 53.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.953 179.143 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.821 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -63.68 -32.48 57.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.831 179.033 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.811 ' CD1' HD13 ' A' ' 19' ' ' LEU . 3.6 mm? -59.45 -36.52 76.1 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.396 179.559 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.9 ttpt -43.02 -42.55 3.89 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.038 0.447 . . . . 0.0 110.291 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.68 ' HB3' HG23 ' A' ' 81' ' ' THR . 1.1 t30 -70.35 -44.96 67.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.7 178.673 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.916 HD12 HD22 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -48.03 -41.49 25.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.421 -179.969 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 1.048 ' CE1' HD12 ' A' ' 30' ' ' LEU . 50.0 m-70 -51.69 -35.01 41.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.927 -179.687 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.53 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.0 mmpt? -92.34 1.81 57.01 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -177.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.961 HD21 ' HA3' ' A' ' 78' ' ' GLY . 7.2 m120 -142.1 10.64 1.95 Allowed 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.385 -0.526 . . . . 0.0 112.323 -179.507 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.794 ' CA ' HD12 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -81.53 -36.88 28.64 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.809 179.734 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.503 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 86.3 t60 -179.99 -52.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.877 0.37 . . . . 0.0 110.672 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 154.71 149.72 5.34 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.536 -0.84 . . . . 0.0 113.046 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.13 103.66 0.01 OUTLIER Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.555 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -54.14 -23.01 12.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.756 0.313 . . . . 0.0 110.696 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.73 -32.97 21.15 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.858 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -85.27 -47.57 9.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.453 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.048 HD12 ' CE1' ' A' ' 20' ' ' HIS . 2.2 tm? -59.53 -29.69 68.07 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.418 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.4 OUTLIER -45.75 -56.45 5.29 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.685 179.738 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.92 -20.24 63.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.932 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.956 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.3 t -87.34 -62.75 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.762 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.602 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -60.99 -24.91 66.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.93 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 14.9 t-20 -58.64 -39.87 81.76 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 177.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.955 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.2 OUTLIER -61.68 -51.47 68.29 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.588 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.004 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -53.94 -68.12 0.21 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.965 178.651 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.772 ' O ' HG22 ' A' ' 41' ' ' ILE . 14.6 tm0? -46.81 -40.08 13.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.741 -179.239 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -69.01 -22.96 64.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.965 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.955 HG23 ' O ' ' A' ' 36' ' ' HIS . 66.5 t -78.33 -38.83 23.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.485 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.826 HD12 HD22 ' A' ' 9' ' ' LEU . 1.1 tp -48.1 -34.64 4.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.412 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -75.69 -37.33 59.62 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 120.967 0.413 . . . . 0.0 109.902 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.515 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -62.47 -30.59 71.36 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.637 178.768 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.552 HG23 HD13 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -86.85 -35.26 8.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.581 179.128 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.414 ' NE2' HG13 ' A' ' 41' ' ' ILE . 23.5 m170 -70.19 -42.12 72.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.738 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.25 -21.76 53.23 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.998 178.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.515 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.3 m-85 -88.64 -45.25 10.0 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.985 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.571 ' HG3' ' HA2' ' A' ' 3' ' ' GLY . 14.6 ptt? -49.79 -24.76 2.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.723 0.297 . . . . 0.0 111.488 -179.492 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 mm100 -90.61 15.29 11.23 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.534 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 102.54 26.13 7.39 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.867 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.41 ' CA ' ' HA ' ' A' ' 47' ' ' PHE . . . -104.07 31.51 8.58 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.649 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.35 23.94 7.76 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.769 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.522 ' O ' HG21 ' A' ' 100' ' ' VAL . 55.0 p -59.74 -20.2 55.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.673 0.273 . . . . 0.0 111.408 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.517 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -93.5 76.69 1.1 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.417 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.457 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . 135.53 -12.28 4.3 Favored Glycine 0 N--CA 1.453 -0.184 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.365 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.522 ' O ' ' HB3' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.4 -53.31 4.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.909 0.385 . . . . 0.0 110.593 179.589 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.552 HD13 HG23 ' A' ' 44' ' ' ILE . 0.5 OUTLIER -54.48 -11.52 0.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.224 -179.553 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -85.53 -51.89 6.2 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.162 179.845 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.98 -26.96 23.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.951 0.405 . . . . 0.0 110.251 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.532 ' CG ' HG13 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -77.67 -36.53 51.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.273 179.464 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.487 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 1.4 tmt? -50.4 -39.12 46.12 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.911 0.386 . . . . 0.0 110.705 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.89 -22.17 66.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.206 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.412 ' HB3' HG21 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -75.4 -42.4 53.85 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -179.396 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.614 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.0 OUTLIER -73.52 -24.53 60.16 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.121 0.486 . . . . 0.0 110.157 -179.989 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -82.77 -31.96 28.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.081 178.391 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -37.24 74.43 Favored 'General case' 0 C--O 1.231 0.079 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.674 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 1.004 HG21 ' HB2' ' A' ' 37' ' ' LEU . 84.9 t -54.29 -39.49 43.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.474 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 1.032 HD11 HD13 ' A' ' 89' ' ' ILE . 1.0 OUTLIER -75.84 -4.88 43.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.524 178.651 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -76.04 -56.81 4.31 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.572 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 7.9 tp10 -53.38 -38.04 62.99 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 122.098 0.951 . . . . 0.0 108.536 177.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.978 HD21 HG13 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -72.77 -67.17 0.58 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 113.485 -1.689 . . . . 0.0 111.939 -179.402 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.437 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 23.2 t-20 -50.68 -26.04 5.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.447 -179.485 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 21.9 m-20 -87.68 7.77 28.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.517 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.514 ' O ' ' N ' ' A' ' 76' ' ' GLN . 72.9 m-70 -154.09 31.92 0.44 Allowed 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.576 HD12 ' C ' ' A' ' 78' ' ' GLY . 0.2 OUTLIER -50.32 90.27 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.289 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -66.25 68.85 0.06 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.417 -177.997 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 58.44 24.78 56.81 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.75 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.961 ' HA3' HD21 ' A' ' 22' ' ' ASN . . . -130.96 46.23 1.09 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.236 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.46 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.2 OUTLIER -55.41 -32.5 62.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.693 0.283 . . . . 0.0 111.296 -179.697 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 37.4 p-80 -57.47 -33.43 67.97 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.052 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.68 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -67.15 -74.36 0.12 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.978 HG13 HD21 ' A' ' 71' ' ' LEU . 29.1 t -50.66 -42.06 21.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.2 179.432 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.467 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 42.4 t60 -48.83 -41.09 31.81 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.426 ' O ' ' HB3' ' A' ' 88' ' ' ASN . 84.7 t60 -76.47 -27.58 56.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.752 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 1.03 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.48 -33.1 7.48 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.149 -179.63 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.481 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -74.38 -45.71 45.1 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 179.102 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -59.14 -29.9 67.75 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 177.943 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.774 ' O ' HD13 ' A' ' 92' ' ' ILE . 0.1 OUTLIER -83.08 -58.63 2.77 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.494 179.344 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 1.032 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -60.57 -48.13 89.88 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.359 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.396 -179.313 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.425 ' N ' HG22 ' A' ' 89' ' ' ILE . 0.6 OUTLIER -61.5 -29.11 69.77 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 120.124 -0.631 . . . . 0.0 109.818 179.784 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -90.68 -2.41 57.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.196 178.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.774 HD13 ' O ' ' A' ' 88' ' ' ASN . 0.9 OUTLIER -77.82 -42.58 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.229 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.64 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -55.95 -27.95 54.76 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.13 178.842 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.64 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 16.9 t60 -62.39 -64.15 1.01 Allowed 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.25 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.434 ' HB3' HD11 ' A' ' 5' ' ' LEU . 4.7 m-70 -63.35 -9.86 13.99 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.127 178.499 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.758 HD21 ' HG ' ' A' ' 9' ' ' LEU . 32.7 mt -89.25 -63.37 1.3 Allowed 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.905 0.384 . . . . 0.0 110.317 179.664 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -63.36 -13.95 44.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.011 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -85.16 -28.7 25.32 Favored 'General case' 0 N--CA 1.458 -0.05 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.553 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.927 HD13 HD23 ' A' ' 5' ' ' LEU . 18.8 tp -62.66 -53.93 47.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.845 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.522 HG21 ' O ' ' A' ' 53' ' ' SER . 38.9 t -71.68 -27.84 29.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.36 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -94.83 33.57 1.46 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.142 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.911 179.851 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.805 -0.118 . . . . 0.0 112.805 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -59.13 -17.32 25.73 Favored 'General case' 0 CA--C 1.514 -0.412 0 O-C-N 122.825 -0.221 . . . . 0.0 111.136 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 1.048 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -50.46 -24.73 3.31 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.057 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.567 ' HA ' HD12 ' A' ' 9' ' ' LEU . 22.4 p-10 -57.95 -41.3 82.57 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.68 178.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -50.26 -30.99 12.99 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.179 0.514 . . . . 0.0 109.88 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.611 ' C ' HD13 ' A' ' 8' ' ' LEU . 2.4 tm? -84.96 -30.46 24.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.091 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.752 ' O ' HD23 ' A' ' 12' ' ' LEU . 15.5 mt -63.56 -34.36 77.64 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.563 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.77 -42.18 67.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.269 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.43 -46.81 69.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.945 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.902 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -58.31 -60.48 3.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.677 179.995 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.752 ' HA ' HD23 ' A' ' 16' ' ' LEU . 0.4 OUTLIER -52.59 -36.44 56.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.082 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -77.1 -29.91 55.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.249 -0.432 . . . . 0.0 109.901 179.206 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.878 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -64.09 -26.86 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.855 178.871 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' A' ' 13' ' ' GLN . 2.5 mm? -63.35 -35.91 81.96 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.694 178.685 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.432 ' HA ' ' CD2' ' A' ' 20' ' ' HIS . 3.0 ttpt -42.98 -35.06 1.11 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.244 0.545 . . . . 0.0 110.076 179.318 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.672 ' HB3' HG23 ' A' ' 81' ' ' THR . 0.8 OUTLIER -78.38 -49.92 12.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.064 178.818 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.809 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -47.37 -43.64 23.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.468 -179.885 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.783 ' N ' HD23 ' A' ' 19' ' ' LEU . 40.7 m-70 -49.49 -36.5 23.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.913 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.446 ' HE3' ' HB2' ' A' ' 20' ' ' HIS . 4.2 mmpt? -90.21 4.66 49.92 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.248 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.624 ' HB2' HG21 ' A' ' 81' ' ' THR . 9.8 m120 -148.61 18.59 1.03 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.998 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.927 ' CG ' HD23 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -88.05 -52.7 5.11 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.39 179.316 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.555 ' HB3' ' CZ2' ' A' ' 23' ' ' TRP . 10.6 t-160 179.94 52.1 0.0 OUTLIER 'General case' 0 C--O 1.232 0.153 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.223 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 70.63 120.62 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.255 0 N-CA-C 115.205 0.842 . . . . 0.0 115.205 177.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.78 130.02 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 115.207 -0.496 . . . . 0.0 114.321 177.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.416 ' HG3' ' CG ' ' A' ' 20' ' ' HIS . 3.5 ttpt -68.05 -14.85 63.29 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.398 -0.401 . . . . 0.0 110.023 178.311 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -46.79 -47.64 20.85 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.47 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -75.68 -46.98 28.21 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.801 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.927 HD23 ' CG ' ' A' ' 23' ' ' TRP . 0.3 OUTLIER -58.47 -28.02 64.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.004 0.43 . . . . 0.0 109.993 179.223 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.431 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 1.2 t60 -45.66 -48.76 14.87 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.451 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.09 -31.14 71.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.246 0.546 . . . . 0.0 110.142 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.931 ' CG1' HG13 ' A' ' 67' ' ' VAL . 2.4 t -72.32 -62.43 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.742 179.425 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.432 ' N ' HG12 ' A' ' 33' ' ' VAL . 0.8 OUTLIER -61.53 -21.57 64.37 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.307 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.431 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 0.6 OUTLIER -60.13 -41.18 92.14 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 177.312 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.633 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.3 OUTLIER -64.69 -49.74 69.76 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 177.205 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.034 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -51.92 -67.15 0.27 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.763 178.505 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.28 -42.88 10.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.812 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.9 m-20 -58.25 -30.32 66.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.031 179.314 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.767 HG12 HG13 ' A' ' 44' ' ' ILE . 21.7 t -65.19 -50.31 74.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.162 179.035 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.856 HD11 HD21 ' A' ' 12' ' ' LEU . 12.5 mm -44.24 -41.15 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.758 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.437 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 0.5 OUTLIER -72.65 -29.89 63.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.703 0.287 . . . . 0.0 111.018 -179.743 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.537 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.3 OUTLIER -84.32 -26.39 28.53 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 178.971 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.767 HG13 HG12 ' A' ' 40' ' ' VAL . 6.4 mm -87.3 -50.57 13.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.353 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.418 ' ND1' ' HA ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -67.21 -26.95 66.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.353 -179.597 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -86.48 -40.87 14.87 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 121.039 0.447 . . . . 0.0 110.054 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.537 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.4 m-85 -73.72 -25.41 60.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.442 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.738 ' SD ' HG22 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -50.62 -39.11 49.39 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.001 0.429 . . . . 0.0 110.83 179.466 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -67.04 -25.29 66.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.757 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 130.12 -3.41 5.95 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.894 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.91 -36.32 26.68 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.141 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.4 ' HA3' ' CD2' ' A' ' 47' ' ' PHE . . . -162.56 25.13 0.22 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 121.054 -0.594 . . . . 0.0 112.178 179.597 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.89 -175.87 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.899 0.38 . . . . 0.0 110.98 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 50.02 59.7 7.27 Favored Glycine 0 CA--C 1.517 0.217 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.66 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 147.9 -19.76 1.43 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.624 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.446 ' O ' ' CB ' ' A' ' 60' ' ' MET . 3.6 pptp? -88.18 -41.28 13.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.778 0.323 . . . . 0.0 111.023 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.672 HD11 ' HB3' ' A' ' 96' ' ' LEU . 14.1 tp -65.55 -9.72 28.86 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.884 -179.575 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -86.3 -49.41 7.7 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.826 179.553 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -87.31 -31.17 20.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.439 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.675 ' HG3' HG13 ' A' ' 40' ' ' VAL . 1.3 tpt -77.54 -30.82 52.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.845 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.52 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -56.24 -43.0 78.22 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.265 179.678 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.79 -20.18 63.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.02 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -74.29 -29.42 61.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.464 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.826 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.4 p90 -87.08 -28.97 22.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.962 0.411 . . . . 0.0 110.682 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.46 ' CG ' ' CE1' ' A' ' 64' ' ' PHE . 4.1 mt-30 -81.23 -34.14 32.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.92 179.525 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 9.0 tm0? -56.58 -35.13 67.85 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.855 0.36 . . . . 0.0 110.787 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 1.034 HG21 ' HB2' ' A' ' 37' ' ' LEU . 9.5 t -55.62 -49.11 76.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.327 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.986 HD11 HD13 ' A' ' 89' ' ' ILE . 1.2 mp -65.1 -10.85 33.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.738 179.178 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -69.54 -59.86 2.7 Favored 'General case' 0 N--CA 1.458 -0.068 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.34 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.483 ' CG ' ' CZ3' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -48.91 -40.91 31.83 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 122.232 1.015 . . . . 0.0 109.198 177.769 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.918 HD21 HG13 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -69.99 -67.78 0.46 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 113.313 -1.767 . . . . 0.0 112.207 -179.279 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.503 ' ND2' HG11 ' A' ' 82' ' ' VAL . 14.2 m120 -49.24 -30.0 6.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.033 -179.185 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -87.4 9.4 20.79 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.628 0.232 . . . . 0.0 111.628 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.507 ' O ' ' N ' ' A' ' 76' ' ' GLN . 85.4 m-70 -151.98 27.89 0.61 Allowed 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.636 HD11 HG23 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -51.38 89.34 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 178.32 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.507 ' N ' ' O ' ' A' ' 74' ' ' HIS . 3.9 mm-40 -66.36 68.09 0.06 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.19 -178.352 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.421 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 56.36 46.56 86.72 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.66 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.437 ' HA3' ' ND2' ' A' ' 22' ' ' ASN . . . -152.21 39.39 0.76 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.502 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.48 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -46.89 -39.73 12.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.716 0.293 . . . . 0.0 111.332 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 31.7 t60 -47.99 -33.57 8.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.55 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.672 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.3 m -67.97 -73.53 0.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.262 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.918 HG13 HD21 ' A' ' 71' ' ' LEU . 25.3 t -50.15 -40.31 17.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.037 179.626 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.475 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 10.3 t60 -48.91 -41.14 32.61 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -76.61 -28.87 56.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.801 178.593 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.96 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.28 -31.16 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.137 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.012 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -76.01 -48.41 21.13 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.568 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.77 -30.06 60.64 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 177.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.691 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.9 m-80 -83.08 -59.52 2.45 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.676 179.152 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.986 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -60.96 -50.32 81.05 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.882 -179.323 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.512 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 1.3 mptp? -61.43 -29.09 69.72 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.878 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -90.69 0.13 57.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.982 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.691 HD13 ' O ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER -78.67 -45.01 25.66 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.031 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.637 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -53.05 -26.35 15.59 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.081 178.419 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.637 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.7 OUTLIER -60.29 -64.22 1.03 Allowed 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.296 -179.365 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.843 ' HB3' HD11 ' A' ' 5' ' ' LEU . 21.8 m-70 -66.02 -9.52 31.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.351 178.668 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.672 ' HB3' HD11 ' A' ' 57' ' ' LEU . 34.9 mt -89.17 -58.16 2.64 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 120.944 0.402 . . . . 0.0 110.442 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.461 ' N ' HD21 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -70.68 -10.93 60.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.061 178.78 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -90.7 -12.99 35.01 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.969 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 1.048 HD13 HD23 ' A' ' 5' ' ' LEU . 4.5 tp -87.11 -56.58 3.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.002 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 45.9 t -62.98 -46.03 97.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.273 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -60.04 -30.03 68.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.011 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.145 -0.931 . . . . 0.0 110.857 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 CA-C-O 120.41 -0.105 . . . . 0.0 113.068 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -82.31 -21.63 36.0 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 116.856 0.328 . . . . 0.0 110.971 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.79 HD23 HD13 ' A' ' 99' ' ' LEU . 0.2 OUTLIER -51.26 -21.98 2.46 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.371 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.458 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 8.5 t30 -62.46 -40.41 96.54 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.789 178.943 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -50.44 -30.12 11.83 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.226 0.536 . . . . 0.0 109.745 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.753 ' O ' HD13 ' A' ' 8' ' ' LEU . 2.9 tm? -85.67 -27.71 25.19 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.953 178.78 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.73 ' O ' HD23 ' A' ' 12' ' ' LEU . 13.4 mt -70.83 -13.06 61.9 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.092 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -75.4 -42.21 54.27 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.805 0.336 . . . . 0.0 111.322 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -56.53 -48.17 77.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.186 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.922 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -54.78 -58.84 5.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.632 -179.874 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.723 ' HA ' HD23 ' A' ' 16' ' ' LEU . 1.4 tt0 -52.38 -35.54 51.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.955 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.87 -28.18 49.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.973 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.87 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -67.64 -26.8 36.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.196 179.286 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.723 HD23 ' HA ' ' A' ' 13' ' ' GLN . 2.4 mm? -62.85 -36.15 82.28 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.247 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.432 ' HA ' ' CE ' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -46.66 -40.27 12.85 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.047 0.451 . . . . 0.0 109.933 179.397 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.579 ' HB3' HG23 ' A' ' 81' ' ' THR . 0.6 OUTLIER -68.21 -41.01 81.94 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.241 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.935 HD12 HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -57.22 -38.37 73.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.737 179.534 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.953 ' CE1' HD12 ' A' ' 30' ' ' LEU . 39.8 m-70 -51.68 -34.84 40.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.853 0.359 . . . . 0.0 111.144 179.689 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.533 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.7 mmpt? -94.15 2.36 55.97 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -178.516 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.675 ' HB2' HG21 ' A' ' 81' ' ' THR . 0.7 OUTLIER -139.54 5.75 2.24 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -179.548 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.987 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -80.47 -37.11 32.47 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.109 179.41 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.494 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 86.0 t60 -176.75 -49.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.736 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 146.86 132.38 2.31 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.102 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 80.48 101.25 0.31 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.522 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.84 -25.45 7.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.753 0.311 . . . . 0.0 110.451 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.81 -31.48 49.28 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.432 179.475 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -85.25 -42.88 14.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.343 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.987 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.2 tm? -62.76 -34.72 77.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.923 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.474 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 33.7 t-80 -47.74 -39.49 17.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.214 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -76.59 -21.89 54.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.676 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.823 ' O ' HG22 ' A' ' 67' ' ' VAL . 1.6 p -91.66 -46.73 14.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.716 -0.22 . . . . 0.0 111.254 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.581 ' HB2' HD11 ' A' ' 30' ' ' LEU . 2.7 t70 -72.97 -27.16 61.65 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.264 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 11.4 t-20 -53.94 -32.68 54.48 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 178.46 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.863 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -63.73 -34.36 77.69 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.287 178.384 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.676 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -71.3 -66.3 0.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.195 179.202 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -47.37 -35.69 8.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.015 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -70.16 -31.71 69.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.229 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.87 HG12 HD11 ' A' ' 44' ' ' ILE . 49.5 t -71.49 -36.9 62.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.213 179.257 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.669 HD11 HD21 ' A' ' 12' ' ' LEU . 35.2 mm -49.79 -35.42 10.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.851 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -25.39 56.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.202 179.326 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.564 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 3.3 m-20 -82.19 -27.24 32.73 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.621 178.627 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.87 HD11 HG12 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -87.08 -52.71 11.33 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.121 179.321 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.13 -27.31 68.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.707 0.289 . . . . 0.0 110.701 -179.733 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -86.83 -32.55 20.23 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.087 0.47 . . . . 0.0 110.161 179.446 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.564 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.3 m-85 -81.6 -45.87 15.21 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.703 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.425 ' HB3' ' HE2' ' A' ' 48' ' ' MET . 11.5 ptp -50.23 -24.4 2.84 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.446 -179.501 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -89.92 13.14 15.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.628 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 104.73 25.94 6.65 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.787 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -102.14 27.01 22.28 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.561 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 101.78 27.34 7.13 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.543 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.522 ' O ' HG11 ' A' ' 100' ' ' VAL . 0.1 OUTLIER -64.89 -15.73 62.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.659 0.266 . . . . 0.0 111.35 -179.917 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.46 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -85.82 73.26 2.59 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.61 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 131.92 -12.43 5.33 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.635 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.534 ' HZ3' ' HB3' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.39 -28.14 21.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.612 0.244 . . . . 0.0 110.956 -179.881 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.517 ' O ' ' HB2' ' A' ' 61' ' ' MET . 0.4 OUTLIER -70.16 -9.2 54.92 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 121.021 -0.272 . . . . 0.0 111.722 -179.679 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.402 ' CG ' ' N ' ' A' ' 59' ' ' GLU . 15.1 pt20 -86.77 -50.81 6.48 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.615 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.402 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 0.4 OUTLIER -86.22 -31.74 21.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.802 -179.726 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.534 ' HB3' ' HZ3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -78.39 -30.8 48.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.098 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.517 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -59.37 -41.75 90.05 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.316 179.708 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -60.78 -19.47 59.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.576 179.503 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.622 ' HB3' HG21 ' A' ' 40' ' ' VAL . 15.8 tt0 -74.26 -31.35 62.52 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.508 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.558 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.0 OUTLIER -87.41 -26.37 23.33 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.01 0.433 . . . . 0.0 109.891 179.608 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -82.51 -32.2 28.83 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.877 178.34 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -59.03 -33.62 70.95 Favored 'General case' 0 C--O 1.23 0.063 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.488 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.823 HG22 ' O ' ' A' ' 33' ' ' VAL . 87.9 t -54.96 -38.35 45.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.178 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 1.039 HD21 HG13 ' A' ' 85' ' ' ILE . 1.8 mp -74.98 -7.55 53.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.513 178.84 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -74.31 -59.45 2.72 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.501 ' HB3' HG21 ' A' ' 33' ' ' VAL . 6.8 tp10 -51.67 -34.48 38.48 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 122.029 0.919 . . . . 0.0 108.786 177.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.935 HD13 HD12 ' A' ' 19' ' ' LEU . 0.3 OUTLIER -72.53 -65.78 0.74 Allowed 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 113.613 -1.631 . . . . 0.0 111.806 -179.418 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.482 ' HA ' HD22 ' A' ' 75' ' ' LEU . 15.1 t-20 -51.18 -24.27 4.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.851 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -85.14 2.78 42.08 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -179.815 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.578 ' O ' ' N ' ' A' ' 76' ' ' GLN . 2.4 m-70 -151.53 36.34 0.57 Allowed 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.677 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.663 HD11 HG23 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -52.08 86.55 0.0 OUTLIER 'General case' 0 C--O 1.231 0.119 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.733 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.578 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -79.16 -39.17 34.14 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.485 -177.399 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -101.1 25.15 29.36 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 120.505 -0.855 . . . . 0.0 114.077 -178.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 88.8 127.32 2.9 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.855 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.561 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -50.46 -19.97 1.01 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.606 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -40.86 -38.16 0.9 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.749 0.309 . . . . 0.0 111.615 -179.632 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.675 HG21 ' HB2' ' A' ' 22' ' ' ASN . 1.3 m -69.48 -73.34 0.16 Allowed 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 178.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.791 ' CG1' HD21 ' A' ' 71' ' ' LEU . 41.8 t -47.39 -37.02 4.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.975 179.568 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.505 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -50.52 -41.46 53.75 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.1 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -76.43 -27.9 56.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.537 178.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 1.039 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -84.07 -33.98 9.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.731 179.972 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.587 ' O ' ' HB2' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -74.31 -51.7 14.43 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 178.939 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 3.9 mm100 -54.16 -28.19 38.61 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.245 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -83.01 -67.12 0.81 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.08 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.969 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -50.46 -33.45 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.528 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.587 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 0.9 OUTLIER -67.75 -24.82 65.39 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.717 -0.793 . . . . 0.0 109.609 179.798 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -86.88 -4.95 59.23 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.075 178.689 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.834 HD13 ' HA ' ' A' ' 89' ' ' ILE . 1.7 mp -78.47 -57.86 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 179.45 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.489 ' CD1' ' C ' ' A' ' 93' ' ' PHE . 0.2 OUTLIER -46.12 -44.79 16.0 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.561 178.958 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.48 ' N ' ' CG ' ' A' ' 93' ' ' PHE . 1.1 t60 -57.92 -61.4 2.56 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.958 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.594 ' HB3' HD11 ' A' ' 5' ' ' LEU . 1.4 m-70 -61.44 -12.19 13.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.526 178.633 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.675 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 20.3 mt -89.25 -65.47 1.01 Allowed 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.927 0.394 . . . . 0.0 110.494 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -64.12 -14.07 52.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.201 179.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.432 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 3.5 tp10 -86.7 -24.98 25.01 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.559 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.79 HD13 HD23 ' A' ' 5' ' ' LEU . 7.5 tp -70.46 -57.14 5.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.626 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.522 HG11 ' O ' ' A' ' 53' ' ' SER . 42.3 t -60.09 -28.47 41.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.18 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -96.08 32.99 1.8 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.136 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.862 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.244 0 CA-C-O 120.417 -0.102 . . . . 0.0 113.007 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.412 ' HA ' ' CE ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -60.44 -18.83 53.63 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 116.807 0.303 . . . . 0.0 111.38 -179.727 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.76 HD13 ' HB3' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -52.84 -20.99 3.69 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.352 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.497 ' HA ' HD12 ' A' ' 9' ' ' LEU . 24.4 p-10 -54.3 -44.71 72.21 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.362 178.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -53.83 -29.43 40.92 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.76 ' HB3' HD13 ' A' ' 5' ' ' LEU . 1.5 tm? -87.41 -28.61 22.04 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.782 178.649 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.83 ' O ' HD23 ' A' ' 12' ' ' LEU . 10.7 mt -60.11 -35.67 75.76 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 121.179 0.514 . . . . 0.0 109.85 179.372 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -55.37 -37.7 67.87 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.153 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.2 -53.01 39.07 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.965 0.412 . . . . 0.0 110.725 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.898 ' O ' HG12 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -54.78 -57.1 12.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.322 179.55 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.671 ' HA ' HD23 ' A' ' 16' ' ' LEU . 31.0 tt0 -52.18 -36.48 51.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.795 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.57 -30.66 57.13 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.898 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -62.81 -26.23 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.828 178.753 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.692 HD12 HD13 ' A' ' 19' ' ' LEU . 3.2 mm? -65.52 -32.77 74.55 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.539 178.737 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.18 -37.11 2.96 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.232 0.539 . . . . 0.0 110.146 179.131 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.661 ' HB3' HG23 ' A' ' 81' ' ' THR . 11.1 m120 -77.4 -49.21 15.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.986 178.801 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.848 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -43.22 -49.33 6.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.818 -179.88 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.836 ' CD2' HD12 ' A' ' 30' ' ' LEU . 41.0 m80 -48.21 -40.54 24.66 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -179.244 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.487 ' HE3' ' HB2' ' A' ' 20' ' ' HIS . 2.8 mmpt? -87.25 7.61 27.73 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -177.699 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.583 ' HB2' HG21 ' A' ' 81' ' ' THR . 30.8 m120 -153.93 19.25 0.51 Allowed 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.315 -0.554 . . . . 0.0 112.195 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.78 ' CB ' HD12 ' A' ' 71' ' ' LEU . 0.5 OUTLIER -87.05 -33.7 19.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.986 0.422 . . . . 0.0 110.08 178.972 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.51 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 3.7 t60 -177.15 -51.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.579 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 160.26 130.26 1.11 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.464 -0.874 . . . . 0.0 113.12 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.68 120.39 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.74 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HD2' ' CG ' ' A' ' 20' ' ' HIS . 18.8 tttt -62.22 -18.64 61.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.651 0.262 . . . . 0.0 110.771 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -50.25 -41.01 49.51 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.98 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -77.86 -49.49 14.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.491 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.836 HD12 ' CD2' ' A' ' 20' ' ' HIS . 1.4 tm? -56.42 -30.23 62.55 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.237 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.3 OUTLIER -45.79 -43.96 13.63 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.995 179.993 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.64 -26.23 64.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.081 0.467 . . . . 0.0 110.54 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.887 ' CG1' HG13 ' A' ' 67' ' ' VAL . 2.3 t -83.5 -62.29 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.888 179.744 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.701 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -58.5 -23.05 57.03 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.333 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 1.7 m-20 -59.73 -41.08 90.11 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 177.77 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.797 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.8 OUTLIER -62.69 -49.48 74.94 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 177.485 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.002 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -56.15 -68.71 0.18 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.571 178.358 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -47.13 -43.86 21.07 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.27 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -61.24 -27.99 68.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.551 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 36' ' ' HIS . 68.0 t -76.0 -41.48 38.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.557 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.793 HD11 HD21 ' A' ' 12' ' ' LEU . 25.9 mm -47.91 -36.8 5.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.164 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 0.1 OUTLIER -71.8 -29.1 64.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.433 179.646 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.555 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 13.7 m-20 -84.19 -27.27 28.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.931 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.732 HG13 HG12 ' A' ' 40' ' ' VAL . 1.8 mt -86.85 -52.77 11.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.188 179.398 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -28.12 69.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.237 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -86.77 -38.68 16.66 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 120.961 0.41 . . . . 0.0 110.316 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.555 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.2 m-85 -77.68 -24.01 49.41 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.711 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.481 ' CE ' HD13 ' A' ' 99' ' ' LEU . 0.8 OUTLIER -52.41 -36.98 55.56 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 121.093 0.473 . . . . 0.0 110.502 179.482 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -71.67 -11.22 60.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.124 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 118.62 20.78 4.13 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.752 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -86.37 27.56 5.64 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.44 -0.886 . . . . 0.0 111.954 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.405 ' O ' ' HG2' ' A' ' 56' ' ' LYS . . . 115.7 27.39 3.05 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.121 -0.561 . . . . 0.0 112.12 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.514 ' O ' HG22 ' A' ' 100' ' ' VAL . 16.4 t -85.76 36.51 0.66 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.753 0.311 . . . . 0.0 111.611 -179.581 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -107.1 -32.89 3.36 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.586 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.427 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . -135.62 7.95 4.26 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.986 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.562 ' HE3' ' HA ' ' A' ' 44' ' ' ILE . 0.0 OUTLIER -88.6 -41.14 12.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.983 0.42 . . . . 0.0 111.375 179.959 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.497 ' O ' ' CB ' ' A' ' 61' ' ' MET . 49.8 tp -60.26 -11.68 7.01 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.817 -0.628 . . . . 0.0 112.289 -178.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 1.7 pp0? -86.24 -50.31 7.06 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.657 -0.417 . . . . 0.0 111.202 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.97 -32.23 20.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.827 0.346 . . . . 0.0 110.454 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.529 ' CG ' HG13 ' A' ' 40' ' ' VAL . 29.9 tpp -75.73 -29.78 59.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.473 179.564 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.497 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 3.0 ttt -52.58 -40.74 62.93 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.905 0.383 . . . . 0.0 110.312 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.6 tptt -63.07 -24.21 67.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.857 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.656 ' HB3' HG21 ' A' ' 40' ' ' VAL . 13.2 tt0 -70.28 -30.88 68.02 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.385 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.8 ' HA ' HD22 ' A' ' 37' ' ' LEU . 0.8 OUTLIER -86.96 -30.04 21.59 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.085 0.469 . . . . 0.0 110.228 179.866 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -82.4 -31.62 29.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.568 179.307 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -59.36 -37.16 77.18 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.786 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 1.002 HG21 ' HB2' ' A' ' 37' ' ' LEU . 3.9 t -53.39 -42.75 49.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.434 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 1.016 HD21 HG13 ' A' ' 85' ' ' ILE . 0.8 OUTLIER -70.76 -7.09 42.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.858 179.306 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -73.37 -55.96 5.69 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.648 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 2.6 tp10 -53.69 -38.01 63.8 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 122.018 0.913 . . . . 0.0 108.885 177.748 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.995 HD21 HG13 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -75.05 -70.82 0.39 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 113.686 -1.597 . . . . 0.0 112.283 -178.928 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.41 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 8.0 p-10 -49.32 -27.38 3.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.608 -179.178 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.409 ' N ' ' OD1' ' A' ' 72' ' ' ASN . 0.7 OUTLIER -91.69 13.65 17.48 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.271 179.998 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.467 ' O ' ' N ' ' A' ' 76' ' ' GLN . 25.2 m80 -151.96 24.31 0.66 Allowed 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.581 ' CD2' HG21 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -47.63 94.74 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.887 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.467 ' N ' ' O ' ' A' ' 74' ' ' HIS . 9.9 tp60 -59.39 -61.61 2.5 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.34 -177.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.4 31.78 0.44 Allowed Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.235 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.556 ' HA3' ' ND2' ' A' ' 22' ' ' ASN . . . -141.15 49.36 0.78 Allowed Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.804 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.454 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -48.63 -27.52 2.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.716 0.293 . . . . 0.0 110.882 179.623 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -67.5 -26.92 66.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.954 179.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.661 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -68.04 -75.1 0.11 Allowed 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 179.274 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.995 HG13 HD21 ' A' ' 71' ' ' LEU . 21.3 t -48.3 -42.95 11.84 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.765 179.356 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.495 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 1.8 t60 -47.93 -42.05 26.29 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.226 0.536 . . . . 0.0 109.797 179.235 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.3 m80 -76.44 -28.42 56.58 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.675 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 1.016 HG13 HD21 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -85.48 -29.99 6.46 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.178 -179.616 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -76.75 -46.82 23.78 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 178.869 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -60.67 -27.91 68.2 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.719 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.7 m-80 -83.05 -58.31 2.91 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.263 178.854 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.988 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -62.17 -47.99 90.55 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.287 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.32 -179.739 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.45 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -61.69 -28.37 69.35 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.042 -0.663 . . . . 0.0 109.724 179.735 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -90.56 -1.26 57.88 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.09 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.719 HD13 ' O ' ' A' ' 88' ' ' ASN . 0.9 OUTLIER -78.64 -44.09 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.287 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.638 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -55.06 -27.0 41.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.137 178.585 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.638 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 2.6 t-160 -62.75 -59.8 4.38 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.853 -179.599 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.45 ' O ' ' HG2' ' A' ' 98' ' ' GLU . 38.9 m170 -67.3 -11.03 56.53 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.189 178.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.583 ' HA ' HD12 ' A' ' 99' ' ' LEU . 36.6 mt -90.0 -56.97 3.02 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.004 0.431 . . . . 0.0 110.818 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -65.23 -10.63 33.46 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.472 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 95' ' ' HIS . 14.2 pt-20 -81.97 -28.07 32.87 Favored 'General case' 0 N--CA 1.461 0.091 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.508 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.716 HD21 HD23 ' A' ' 5' ' ' LEU . 1.7 mt -69.43 -64.05 0.95 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.183 0.516 . . . . 0.0 110.639 179.681 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 53' ' ' SER . 21.7 t -59.77 -26.58 35.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.012 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -85.39 -35.15 21.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.775 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.405 ' CB ' ' O ' ' A' ' 98' ' ' GLU . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.141 -0.933 . . . . 0.0 110.873 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 CA-C-O 120.415 -0.103 . . . . 0.0 112.892 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.8 tpmt? -84.12 -17.73 39.14 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 116.765 0.282 . . . . 0.0 110.649 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.93 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -53.79 -20.63 5.96 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 177.985 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.435 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 35.5 p-10 -61.2 -42.6 98.87 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.677 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -49.43 -29.47 6.54 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.17 0.509 . . . . 0.0 109.802 179.093 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.537 ' O ' HD13 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -84.39 -34.46 23.57 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.067 179.038 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.715 ' O ' HD23 ' A' ' 12' ' ' LEU . 7.8 mt -64.07 -29.56 70.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.082 0.468 . . . . 0.0 110.598 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.63 -49.94 64.14 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.337 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -54.52 -46.07 73.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.881 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.991 ' O ' HG12 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -54.53 -61.0 2.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.491 179.747 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.809 ' HA ' HD23 ' A' ' 16' ' ' LEU . 4.9 tt0 -52.76 -37.42 59.42 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.617 -179.089 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.41 -30.26 53.47 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.035 0.445 . . . . 0.0 110.052 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.991 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.9 OUTLIER -64.96 -27.48 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.104 178.984 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.969 HD13 HD11 ' A' ' 85' ' ' ILE . 2.6 mm? -61.63 -39.69 92.19 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 178.291 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.3 ttpt -39.14 -39.55 0.6 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.005 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.812 ' HB3' HG23 ' A' ' 81' ' ' THR . 7.4 m-20 -66.01 -55.68 15.47 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.419 -0.809 . . . . 0.0 108.982 178.018 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.905 HD21 HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -39.47 -47.57 1.86 Allowed 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 114.561 -1.2 . . . . 0.0 111.969 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.798 ' NE2' HD12 ' A' ' 30' ' ' LEU . 67.6 m80 -50.64 -37.03 38.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.58 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.6 mmpt? -94.23 8.37 42.0 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -177.572 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.589 ' HB2' HG21 ' A' ' 81' ' ' THR . 35.0 m120 -152.69 10.14 0.48 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.143 -0.623 . . . . 0.0 112.57 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 1.041 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -75.16 -34.71 61.62 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.846 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.51 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 81.7 t60 -178.41 -50.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.672 178.893 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -130.88 -91.68 0.57 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.027 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -136.11 -142.52 4.51 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.888 -0.672 . . . . 0.0 111.785 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.426 ' HA ' ' HB3' ' A' ' 30' ' ' LEU . 9.8 tttm -93.62 -18.53 22.08 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.612 0.244 . . . . 0.0 111.125 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -54.66 -56.31 20.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.804 0.335 . . . . 0.0 110.928 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -79.96 -17.41 53.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.021 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.041 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.2 tm? -80.9 -31.74 35.06 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.038 0.447 . . . . 0.0 109.936 179.455 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.426 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.4 OUTLIER -51.47 -36.91 46.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.116 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -76.57 -25.22 53.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.505 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.778 ' CG1' HD22 ' A' ' 30' ' ' LEU . 1.5 p -90.35 -42.71 14.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.062 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.498 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 1.2 t0 -73.13 -31.77 64.5 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 179.11 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 13.1 t-20 -51.97 -29.55 21.08 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.798 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.9 OUTLIER -72.69 -36.41 67.87 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.344 -0.844 . . . . 0.0 109.408 178.574 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.771 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -68.45 -66.81 0.52 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.38 179.267 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -45.39 -36.0 3.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.307 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -65.99 -31.07 71.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.943 0.402 . . . . 0.0 110.39 179.66 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.847 HG12 ' CG1' ' A' ' 44' ' ' ILE . 32.6 t -64.55 -53.86 37.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.8 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.816 HD11 HD21 ' A' ' 12' ' ' LEU . 38.3 mm -38.1 -42.35 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.935 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -71.7 -39.68 70.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.793 0.33 . . . . 0.0 110.405 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.473 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.7 OUTLIER -71.72 -28.64 63.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.549 179.399 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.847 ' CG1' HG12 ' A' ' 40' ' ' VAL . 7.1 mm -86.83 -40.53 14.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.867 0.365 . . . . 0.0 110.686 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.687 ' NE2' HG23 ' A' ' 41' ' ' ILE . 13.7 m170 -73.87 -39.01 64.26 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.345 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -74.38 -26.09 59.89 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.473 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.6 m-85 -88.61 -46.19 9.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.979 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.44 ' HE1' ' N ' ' A' ' 5' ' ' LEU . 8.4 ptm -46.49 -32.38 3.29 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.84 0.352 . . . . 0.0 111.406 -179.522 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -26.57 66.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.244 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 146.52 -13.75 1.59 Allowed Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.599 -0.81 . . . . 0.0 113.009 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.73 -42.65 37.13 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.86 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 168.69 39.2 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.607 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.432 ' HB3' ' HA ' ' A' ' 48' ' ' MET . 7.8 p -59.35 -24.38 63.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.735 0.302 . . . . 0.0 111.032 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.7 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -88.95 57.93 4.02 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.298 179.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 171.14 -28.1 0.11 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.937 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.609 ' HE3' HD13 ' A' ' 44' ' ' ILE . 0.6 OUTLIER -87.94 -30.04 20.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.921 0.361 . . . . 0.0 110.974 -179.866 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.601 HD13 ' HZ1' ' A' ' 56' ' ' LYS . 12.8 tp -61.53 -10.92 8.97 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.046 -0.261 . . . . 0.0 111.602 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.421 ' CG ' ' N ' ' A' ' 59' ' ' GLU . 13.4 pt20 -85.75 -49.86 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.751 -0.38 . . . . 0.0 110.798 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.421 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 19.7 mm-40 -87.42 -33.8 18.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.133 0.492 . . . . 0.0 110.295 179.342 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.728 ' HG3' HG13 ' A' ' 40' ' ' VAL . 3.5 tpt -74.6 -27.19 60.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.834 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.503 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 3.9 ttp -58.48 -47.61 83.49 Favored 'General case' 0 C--O 1.231 0.086 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.013 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -62.28 -24.51 67.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.512 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.426 ' HG2' HG22 ' A' ' 40' ' ' VAL . 1.1 tp10 -67.8 -32.29 72.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.318 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.555 ' HA ' HD22 ' A' ' 37' ' ' LEU . 0.9 OUTLIER -86.99 -33.47 19.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.888 0.375 . . . . 0.0 110.511 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.404 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 10.2 tt0 -80.76 -32.8 35.41 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.997 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.66 -33.09 71.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.768 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.771 HG22 ' O ' ' A' ' 33' ' ' VAL . 95.1 t -58.46 -44.32 88.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.57 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 1.062 HD11 HD13 ' A' ' 89' ' ' ILE . 1.3 mp -73.21 -6.37 45.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.78 179.18 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -73.1 -54.37 8.68 Favored 'General case' 0 N--CA 1.457 -0.122 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.508 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 5.3 tp10 -57.95 -31.72 67.12 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.881 0.848 . . . . 0.0 108.967 177.719 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 1.01 ' CD2' HG13 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -76.98 -72.04 0.37 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.905 -1.498 . . . . 0.0 112.378 -178.8 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.53 ' HA ' HG11 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -51.45 -26.13 7.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.46 -179.171 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -86.45 8.15 22.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.166 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.527 ' O ' ' N ' ' A' ' 76' ' ' GLN . 36.5 m-70 -146.41 29.46 1.05 Allowed 'General case' 0 CA--C 1.523 -0.094 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.586 HD11 HG23 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -49.93 88.9 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.236 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 74' ' ' HIS . 1.4 tm0? -62.37 -48.75 78.38 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.94 0.4 . . . . 0.0 110.76 -178.696 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -172.54 34.91 0.13 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.334 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.442 ' HA3' ' ND2' ' A' ' 22' ' ' ASN . . . -142.55 49.77 0.73 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.659 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.442 ' N ' ' HD2' ' A' ' 79' ' ' LYS . 0.0 OUTLIER -45.5 -36.26 4.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.618 0.246 . . . . 0.0 111.246 179.952 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 36.0 m80 -59.72 -40.78 89.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.605 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.9 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.4 m -59.28 -64.47 0.93 Allowed 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.939 179.118 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 1.01 HG13 ' CD2' ' A' ' 71' ' ' LEU . 9.5 t -60.05 -49.29 84.6 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.093 -179.721 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.521 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 1.4 m-70 -50.77 -40.23 54.48 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.946 -0.301 . . . . 0.0 110.773 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -75.41 -56.4 4.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.909 0.385 . . . . 0.0 110.28 179.458 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.969 HD11 HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -58.33 -32.98 46.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.751 179.477 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.619 ' HA ' HD22 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -81.16 -39.87 24.85 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.638 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.521 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 1.1 mp0 -66.79 -25.94 66.71 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 177.12 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.791 ' O ' HD13 ' A' ' 92' ' ' ILE . 2.4 m120 -82.65 -52.96 6.31 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.746 178.692 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 1.062 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -66.18 -50.49 68.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.932 179.843 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.502 ' N ' HG22 ' A' ' 89' ' ' ILE . 0.3 OUTLIER -56.96 -27.31 61.07 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 120.43 -0.508 . . . . 0.0 109.991 -179.855 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -90.7 -5.34 55.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.354 178.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.791 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.0 OUTLIER -78.6 -46.2 24.97 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 179.38 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.622 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.2 OUTLIER -48.53 -28.92 3.69 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.348 178.976 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.622 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.5 OUTLIER -60.12 -62.99 1.46 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.102 -179.518 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.494 ' HB3' HD11 ' A' ' 5' ' ' LEU . 1.7 m-70 -68.07 -8.72 40.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.345 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.482 ' HB2' ' HA ' ' A' ' 93' ' ' PHE . 23.0 mt -88.52 -56.17 3.42 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.995 0.426 . . . . 0.0 110.009 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.412 ' HG2' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -71.63 -9.81 58.81 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.824 178.486 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -88.16 -30.5 19.74 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.514 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.93 HD13 HD23 ' A' ' 5' ' ' LEU . 10.8 tp -67.6 -56.07 10.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.918 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.7 HG11 ' HA2' ' A' ' 54' ' ' GLY . 21.2 t -62.2 -37.99 79.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.417 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -63.73 -39.22 93.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.938 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.874 179.94 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.4 mtm . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.747 0.308 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -59.97 121.78 12.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.693 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.449 ' HA2' ' HB3' ' A' ' 48' ' ' MET . . . -179.5 -38.3 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.553 -0.832 . . . . 0.0 112.788 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.0 tptt -62.97 -17.42 62.04 Favored 'General case' 0 CA--C 1.513 -0.455 0 O-C-N 122.809 -0.23 . . . . 0.0 111.327 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 1.089 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -52.88 -23.43 7.07 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.005 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.415 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 39.4 p-10 -61.25 -39.69 91.27 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.851 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -50.13 -29.61 9.48 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.079 0.466 . . . . 0.0 110.185 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.6 ' C ' HD13 ' A' ' 8' ' ' LEU . 1.8 tm? -87.66 -29.35 21.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.281 179.344 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.686 ' HB3' HD11 ' A' ' 41' ' ' ILE . 11.1 mt -67.74 -35.54 78.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.563 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -51.78 -47.8 64.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.664 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -49.16 -46.29 45.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.26 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.907 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -55.46 -58.71 6.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.762 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.527 ' HA ' HD23 ' A' ' 16' ' ' LEU . 40.2 tt0 -55.16 -37.73 67.37 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.336 -179.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -76.41 -26.46 55.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.87 0.367 . . . . 0.0 110.175 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.874 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -69.87 -27.28 32.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.345 179.31 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.712 ' CD1' HD13 ' A' ' 19' ' ' LEU . 2.7 mm? -62.63 -40.39 96.83 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.179 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -41.24 -39.74 1.43 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.069 0.462 . . . . 0.0 110.54 179.519 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.668 ' HB3' HG23 ' A' ' 81' ' ' THR . 1.1 m-20 -70.7 -47.04 61.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.528 178.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.912 HD21 HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -47.67 -40.81 20.88 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.392 179.806 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 1.091 ' CE1' HD12 ' A' ' 30' ' ' LEU . 63.5 m-70 -52.48 -39.29 61.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.908 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.542 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 3.9 mmpt? -86.88 5.07 38.7 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -177.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.528 ' HB2' HG21 ' A' ' 81' ' ' THR . 39.1 m-20 -152.97 19.93 0.58 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.745 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.824 ' CB ' HD12 ' A' ' 71' ' ' LEU . 0.8 OUTLIER -84.84 -31.17 23.95 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.645 179.156 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.504 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 84.6 t60 -178.44 -52.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.541 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.23 -87.0 0.3 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.94 -0.647 . . . . 0.0 111.827 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -136.15 -145.52 5.07 Favored Glycine 0 N--CA 1.442 -0.931 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.605 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.436 ' HD2' ' CE1' ' A' ' 20' ' ' HIS . 1.2 ttpt -94.1 -20.88 19.5 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.603 0.24 . . . . 0.0 111.339 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -52.29 -53.85 38.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.557 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -79.41 -27.21 41.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.317 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.091 HD12 ' CE1' ' A' ' 20' ' ' HIS . 2.1 tm? -75.24 -29.28 60.18 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -49.05 -38.29 23.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.653 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -75.91 -23.57 55.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.715 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.911 ' CG1' HG13 ' A' ' 67' ' ' VAL . 0.9 OUTLIER -87.26 -58.16 3.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.831 179.764 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.62 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -59.32 -24.23 63.14 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.898 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.433 ' O ' ' HB2' ' A' ' 39' ' ' ASN . 1.0 OUTLIER -56.67 -44.3 81.28 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 177.816 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.821 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.8 m-70 -57.82 -49.61 76.08 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 177.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.967 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -57.4 -66.64 0.43 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.591 178.536 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.68 ' O ' HG22 ' A' ' 41' ' ' ILE . 0.3 OUTLIER -46.46 -41.99 14.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.684 -179.59 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 35' ' ' ASN . 2.1 t-20 -68.52 -26.02 65.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.875 0.369 . . . . 0.0 110.615 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 1.059 HG12 HD11 ' A' ' 44' ' ' ILE . 53.8 t -77.32 -37.71 25.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.525 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.686 HD11 ' HB3' ' A' ' 9' ' ' LEU . 4.8 tp -48.17 -37.31 7.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 120.995 0.426 . . . . 0.0 110.664 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -75.67 -41.21 54.47 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.699 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.411 ' HB3' ' HE3' ' A' ' 60' ' ' MET . 4.0 m-20 -60.53 -30.23 69.62 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 1.059 HD11 HG12 ' A' ' 40' ' ' VAL . 4.0 mt -86.54 -41.93 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.886 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 25.8 m170 -62.44 -43.97 97.54 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.273 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -73.89 -11.22 60.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.076 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.48 ' CD1' ' C ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -85.43 -42.03 14.87 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.76 179.781 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.537 ' CE ' HD12 ' A' ' 9' ' ' LEU . 1.6 tpp -45.73 -27.74 0.88 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.925 -179.006 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.86 19.96 10.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.788 0.328 . . . . 0.0 111.763 -179.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 75.85 33.16 51.79 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.644 -0.788 . . . . 0.0 113.121 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -95.19 40.24 2.71 Favored Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 109.961 -1.255 . . . . 0.0 109.961 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 123.11 21.29 2.59 Favored Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 114.503 -0.849 . . . . 0.0 111.015 -178.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.439 ' HA ' ' CD1' ' A' ' 47' ' ' PHE . 33.4 p -61.36 166.09 4.17 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.088 0.471 . . . . 0.0 111.433 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.671 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . 51.36 51.38 37.1 Favored Glycine 0 N--CA 1.452 -0.284 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.909 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.402 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . 171.61 -33.83 0.14 Allowed Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.288 -0.958 . . . . 0.0 113.192 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.581 ' HD3' ' N ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -88.41 -26.19 22.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.874 0.337 . . . . 0.0 111.689 -179.491 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.581 ' N ' ' HD3' ' A' ' 56' ' ' LYS . 19.7 tp -70.12 -8.14 47.2 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.575 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 55' ' ' GLY . 17.3 pt20 -86.39 -49.88 7.31 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.924 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.4 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 3.8 mt-10 -86.88 -34.1 19.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.447 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.496 ' HG3' HG13 ' A' ' 40' ' ' VAL . 8.7 tpp -74.22 -29.51 61.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.551 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.508 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 5.9 ttm -56.06 -50.74 70.12 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.978 0.418 . . . . 0.0 110.138 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -59.52 -20.87 58.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.824 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.631 ' HB3' HG21 ' A' ' 40' ' ' VAL . 0.7 OUTLIER -71.83 -33.2 68.28 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.043 179.935 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.474 ' CE2' ' HG3' ' A' ' 61' ' ' MET . 1.1 p90 -84.08 -25.81 29.5 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 120.983 0.42 . . . . 0.0 110.068 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -35.33 27.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.256 178.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.08 -32.44 61.95 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.445 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.967 HG21 ' HB2' ' A' ' 37' ' ' LEU . 96.3 t -58.84 -38.74 74.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.005 179.154 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.996 HD21 HG13 ' A' ' 85' ' ' ILE . 0.7 OUTLIER -78.62 -4.33 48.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.233 178.453 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -76.41 -56.74 4.35 Favored 'General case' 0 CA--C 1.521 -0.14 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.604 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 3.1 tp10 -54.02 -36.62 63.2 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.99 0.9 . . . . 0.0 108.674 177.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.925 HD21 HG13 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -74.73 -69.64 0.45 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 113.553 -1.658 . . . . 0.0 112.168 -179.223 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.41 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 42.2 t-20 -50.16 -26.14 4.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.633 -179.282 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -87.27 7.82 26.86 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.428 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.499 ' O ' ' N ' ' A' ' 76' ' ' GLN . 5.7 m-70 -155.38 34.51 0.37 Allowed 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.582 ' CD2' HG21 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -51.23 90.34 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.105 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.029 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.499 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -65.64 68.3 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.536 -177.965 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 57.45 29.67 60.87 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.646 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.553 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -136.86 46.14 1.04 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.476 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.46 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.7 OUTLIER -52.67 -38.99 61.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.751 0.31 . . . . 0.0 111.224 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -49.58 -32.45 12.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.568 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.668 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -69.03 -74.16 0.13 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.356 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.925 HG13 HD21 ' A' ' 71' ' ' LEU . 22.6 t -49.46 -39.19 13.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.914 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.453 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.3 OUTLIER -49.02 -41.51 34.97 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 179.234 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -76.43 -28.92 56.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.694 178.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.996 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.57 -33.41 7.68 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.346 -179.579 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -74.43 -43.06 57.91 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 179.115 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -62.49 -29.33 70.46 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.716 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.8 m-80 -82.92 -57.05 3.47 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.443 179.154 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.972 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -63.51 -51.15 74.15 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.347 -179.675 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.493 ' N ' HG22 ' A' ' 89' ' ' ILE . 5.8 mmtp -59.15 -27.53 65.73 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.119 -0.632 . . . . 0.0 109.782 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -90.72 -2.22 57.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.146 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.716 HD13 ' O ' ' A' ' 88' ' ' ASN . 0.9 OUTLIER -78.44 -46.62 25.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.339 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.639 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -52.5 -27.56 16.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.41 178.927 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.639 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.2 OUTLIER -65.16 -64.06 0.95 Allowed 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.661 -179.586 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.462 ' O ' HD21 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -61.36 -11.51 10.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.993 178.328 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.589 HD11 HD21 ' A' ' 9' ' ' LEU . 24.7 mt -89.34 -65.39 1.02 Allowed 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 120.949 0.404 . . . . 0.0 110.587 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.451 ' N ' HD21 ' A' ' 57' ' ' LEU . 25.4 tt0 -64.16 -14.24 53.78 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.176 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 11.2 tt0 -83.33 -24.87 31.94 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.524 179.488 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 1.089 HD13 HD23 ' A' ' 5' ' ' LEU . 31.4 tp -70.82 -61.48 1.75 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.744 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.671 HG11 ' HA2' ' A' ' 54' ' ' GLY . 22.7 t -65.56 -31.58 54.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.137 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -100.46 32.8 2.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.99 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.915 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.7 ttm . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.812 0.339 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.413 ' CE2' ' OXT' ' A' ' 102' ' ' ARG . 96.1 m-85 -96.96 40.88 1.13 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.823 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -118.54 -24.2 3.22 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.863 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.7 tptm -63.8 -15.62 59.2 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.705 0.252 . . . . 0.0 111.232 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.831 HD11 ' HB3' ' A' ' 95' ' ' HIS . 0.1 OUTLIER -54.17 -22.15 10.59 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.861 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.48 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 20.5 p-10 -54.41 -45.24 72.92 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.649 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.16 -33.63 19.68 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.296 0.57 . . . . 0.0 109.539 178.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.587 ' C ' HD13 ' A' ' 8' ' ' LEU . 1.7 tm? -87.85 -30.46 20.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.01 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.938 HD12 ' HE3' ' A' ' 48' ' ' MET . 0.4 OUTLIER -65.89 -38.09 87.84 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.082 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -50.51 -40.76 52.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.229 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -47.07 -42.17 18.28 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.075 0.464 . . . . 0.0 110.485 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.015 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -57.31 -61.14 2.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.268 179.234 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.737 ' H ' HD23 ' A' ' 12' ' ' LEU . 1.1 tm0? -50.63 -38.49 46.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.054 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.81 -31.04 61.6 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.832 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -64.97 -29.85 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.735 178.85 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.679 HD21 HD11 ' A' ' 89' ' ' ILE . 3.2 mm? -63.84 -28.43 69.85 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.092 178.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -48.95 -40.97 32.41 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-O 121.155 0.502 . . . . 0.0 110.041 179.364 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.779 ' HB3' HG23 ' A' ' 81' ' ' THR . 8.7 m120 -72.41 -45.67 58.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.79 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.928 HD12 HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -43.93 -49.25 8.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.592 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.735 ' CD2' HD12 ' A' ' 30' ' ' LEU . 43.9 m80 -45.79 -39.38 8.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.098 -179.328 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.468 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 4.3 mmpt? -91.17 6.62 44.36 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -177.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.879 HD21 ' HA3' ' A' ' 78' ' ' GLY . 7.8 m120 -146.5 10.84 1.11 Allowed 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.497 -0.481 . . . . 0.0 112.279 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.922 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -82.07 -35.31 28.8 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.789 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.477 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 85.7 t60 -179.13 -51.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.009 0.433 . . . . 0.0 110.726 179.518 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -134.59 -93.72 0.47 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.903 -0.665 . . . . 0.0 111.747 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -129.13 -148.03 6.5 Favored Glycine 0 N--CA 1.44 -1.081 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.443 ' HD3' ' CE1' ' A' ' 31' ' ' HIS . 7.9 ttmt -94.35 -15.72 24.13 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.626 0.25 . . . . 0.0 111.476 179.583 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -55.91 -52.28 64.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.862 0.363 . . . . 0.0 111.027 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -81.97 -28.57 32.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.598 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.922 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.4 tm? -70.59 -32.24 69.54 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 178.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.443 ' CE1' ' HD3' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -44.51 -55.12 5.36 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.051 179.904 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -20.41 62.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.117 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.98 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.0 OUTLIER -90.01 -60.25 2.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.716 179.799 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.577 ' H ' HD13 ' A' ' 30' ' ' LEU . 1.0 OUTLIER -62.88 -25.62 68.39 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.182 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.412 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 10.8 t-20 -54.7 -37.72 66.15 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 177.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.893 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -66.15 -49.61 66.81 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.139 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.952 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -53.09 -67.74 0.23 Allowed 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.824 178.595 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.486 ' O ' HG22 ' A' ' 41' ' ' ILE . 5.6 tt0 -46.25 -43.18 15.32 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.262 -179.566 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -63.73 -24.09 67.63 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.761 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 36' ' ' HIS . 50.8 t -70.55 -56.02 12.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.695 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.775 HD12 HD22 ' A' ' 9' ' ' LEU . 0.1 OUTLIER -44.27 -39.75 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.965 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 3.3 pt-20 -71.15 -32.37 68.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.342 . . . . 0.0 110.404 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.547 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -79.04 -27.04 43.12 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.766 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.702 ' CD1' HG12 ' A' ' 40' ' ' VAL . 20.6 mt -86.92 -26.11 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.109 178.506 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.466 ' NE2' HG13 ' A' ' 41' ' ' ILE . 20.3 m170 -77.88 -57.5 3.77 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.865 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.28 -25.66 67.25 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.072 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.547 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.9 m-85 -88.98 -28.13 20.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.665 179.096 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.938 ' HE3' HD12 ' A' ' 9' ' ' LEU . 1.9 ttt -49.46 -28.56 5.43 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.583 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -29.62 43.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.063 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 129.85 -6.3 6.13 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.905 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.45 -29.78 7.66 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.144 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.438 ' HA3' ' CE2' ' A' ' 47' ' ' PHE . . . -157.73 23.0 0.41 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.287 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.5 p -59.97 165.5 3.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.815 0.341 . . . . 0.0 110.543 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.664 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . 66.46 51.13 44.97 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.531 -0.842 . . . . 0.0 111.995 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 161.19 -24.07 0.24 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.42 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.486 ' HZ3' HD13 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -84.27 -43.19 15.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.682 0.277 . . . . 0.0 111.134 179.854 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.533 ' O ' ' CB ' ' A' ' 61' ' ' MET . 14.3 tp -65.21 -9.66 25.3 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.268 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -86.44 -50.34 6.95 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.793 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -87.33 -31.73 20.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.894 0.378 . . . . 0.0 110.594 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.76 ' HG3' HG13 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -78.19 -28.01 48.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.089 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.533 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.5 OUTLIER -59.32 -41.45 89.09 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.071 179.656 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -71.15 -15.73 62.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.083 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.439 ' HG2' HG22 ' A' ' 40' ' ' VAL . 0.9 OUTLIER -80.96 -25.93 36.99 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.273 -179.81 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.61 ' HB3' HG11 ' A' ' 40' ' ' VAL . 1.2 p90 -86.91 -33.82 19.59 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 121.03 0.443 . . . . 0.0 110.039 179.561 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.455 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 10.5 tt0 -79.14 -35.67 41.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.731 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.6 tp60 -54.06 -33.5 57.63 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.969 0.414 . . . . 0.0 110.477 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.98 HG13 ' CG1' ' A' ' 33' ' ' VAL . 71.8 t -59.41 -39.5 79.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.217 179.262 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 1.031 HD21 HG13 ' A' ' 85' ' ' ILE . 0.5 OUTLIER -76.19 -5.67 47.82 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.394 178.68 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -75.68 -56.87 4.27 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.487 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 0.5 OUTLIER -53.57 -38.12 63.58 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 122.143 0.973 . . . . 0.0 108.674 177.594 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.958 HD21 HG13 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -72.41 -67.36 0.56 Allowed 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 113.434 -1.712 . . . . 0.0 111.848 -179.345 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.422 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 65.9 t30 -51.04 -26.08 5.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.508 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -88.11 9.38 22.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.367 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.502 ' O ' ' N ' ' A' ' 76' ' ' GLN . 73.0 m-70 -154.97 32.31 0.4 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 111.768 0.284 . . . . 0.0 111.768 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.568 HD21 ' HB ' ' A' ' 82' ' ' VAL . 0.2 OUTLIER -52.67 88.31 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.086 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.502 ' N ' ' O ' ' A' ' 74' ' ' HIS . 1.2 mm-40 -67.97 69.7 0.13 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.441 . . . . 0.0 111.171 -178.281 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 60.88 21.57 58.88 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.584 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.879 ' HA3' HD21 ' A' ' 22' ' ' ASN . . . -121.94 39.41 2.33 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.312 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.467 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -49.26 -40.65 35.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.866 0.365 . . . . 0.0 111.469 -179.767 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 1.9 m170 -55.43 -33.9 63.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.58 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.779 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.3 m -67.45 -74.41 0.12 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.958 HG13 HD21 ' A' ' 71' ' ' LEU . 39.7 t -51.12 -40.73 22.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.083 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.469 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 56.6 t-80 -49.84 -40.88 43.75 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -76.54 -28.35 56.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.635 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 1.031 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.3 -33.13 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.962 -179.589 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.506 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.2 OUTLIER -74.38 -46.53 39.82 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.851 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.35 -30.28 66.61 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.796 ' O ' HD13 ' A' ' 92' ' ' ILE . 2.5 m-80 -82.75 -68.15 0.73 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.335 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 1.015 ' CG1' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -50.53 -45.76 26.47 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.473 -179.761 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.414 ' N ' HG22 ' A' ' 89' ' ' ILE . 1.2 mmmm -62.53 -30.21 71.12 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.734 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -90.75 -2.32 57.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.278 178.462 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.796 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -78.68 -35.63 18.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.634 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -65.37 -30.81 71.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.506 179.177 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.634 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.1 OUTLIER -59.88 -57.09 14.38 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.318 -179.207 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.831 ' HB3' HD11 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -69.81 -9.96 56.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.387 178.87 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.676 HD21 ' HG ' ' A' ' 9' ' ' LEU . 35.5 mt -89.43 -54.24 4.18 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.456 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.405 ' HG2' HD23 ' A' ' 57' ' ' LEU . 1.6 mt-10 -62.97 -13.15 31.36 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 177.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.43 ' O ' ' CB ' ' A' ' 102' ' ' ARG . 0.1 OUTLIER -80.75 -1.3 42.22 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.836 179.383 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.668 HD21 ' HB2' ' A' ' 5' ' ' LEU . 4.1 mt -96.1 -67.2 0.86 Allowed 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.127 0.489 . . . . 0.0 110.597 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.664 HG11 ' HA2' ' A' ' 54' ' ' GLY . 41.3 t -59.78 -27.45 38.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.946 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 97' ' ' GLU . 10.9 t-80 -86.91 -33.08 19.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.107 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.43 ' CB ' ' O ' ' A' ' 98' ' ' GLU . 38.2 ttp180 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.952 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 ttt . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.843 0.354 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.426 ' CE1' ' HG3' ' A' ' 102' ' ' ARG . 66.6 m-85 -91.6 112.54 24.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.885 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.48 ' HA2' ' HG3' ' A' ' 48' ' ' MET . . . -175.13 -36.65 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.609 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.7 tptt -55.87 -19.55 12.25 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.54 0.17 . . . . 0.0 111.241 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.863 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -49.65 -23.51 1.76 Allowed 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.35 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.422 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 12.2 p30 -58.42 -42.74 87.9 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.742 178.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -48.81 -30.6 5.91 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.273 0.558 . . . . 0.0 109.752 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.835 ' O ' HD13 ' A' ' 8' ' ' LEU . 2.2 tm? -83.64 -35.58 24.49 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.933 178.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.678 ' HB3' HD11 ' A' ' 41' ' ' ILE . 7.9 mt -62.23 -40.95 97.87 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.82 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -49.0 -44.26 40.99 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.683 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.407 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 0.9 OUTLIER -49.71 -45.74 49.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.101 -179.821 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.954 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -56.54 -61.64 2.28 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.717 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.574 ' H ' HD23 ' A' ' 12' ' ' LEU . 0.9 OUTLIER -51.53 -39.3 57.44 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.481 -179.138 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -75.53 -28.77 59.2 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.856 HG13 ' HB ' ' A' ' 85' ' ' ILE . 0.3 OUTLIER -67.69 -27.42 38.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.976 179.031 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.711 ' CD1' HD13 ' A' ' 19' ' ' LEU . 2.9 mm? -64.8 -29.7 70.68 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.722 178.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.433 ' HA ' ' ND1' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -47.51 -39.95 17.42 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.21 0.529 . . . . 0.0 110.075 179.277 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.859 ' HB3' HG23 ' A' ' 81' ' ' THR . 2.1 m120 -73.82 -45.49 51.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.072 178.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.858 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -46.9 -42.95 18.39 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.618 -179.836 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.761 ' CD2' HD12 ' A' ' 30' ' ' LEU . 40.5 m80 -48.81 -40.82 30.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.869 0.366 . . . . 0.0 111.734 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.5 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 3.9 mmpt? -89.2 5.78 43.17 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.697 ' O ' HD13 ' A' ' 75' ' ' LEU . 3.8 m120 -142.03 5.21 1.7 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.468 -0.493 . . . . 0.0 112.274 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.912 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -81.07 -51.91 7.97 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.738 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.518 ' HB3' ' CZ2' ' A' ' 23' ' ' TRP . 8.7 t-160 179.56 58.67 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.939 0.4 . . . . 0.0 110.876 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 116.72 -104.05 1.18 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.061 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -128.81 -146.24 6.14 Favored Glycine 0 N--CA 1.443 -0.9 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.961 179.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.49 ' HG3' ' CD2' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -94.18 -13.28 26.84 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -49.14 -62.66 1.41 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.8 m-80 -77.32 -27.83 53.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.695 0.283 . . . . 0.0 110.728 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.912 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.3 tm? -68.37 -31.18 70.37 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.449 ' N ' ' O ' ' A' ' 27' ' ' LYS . 3.8 t-80 -45.25 -58.69 3.1 Favored 'General case' 0 CA--C 1.523 -0.091 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.803 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.4 -21.99 52.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.015 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.96 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.5 t -87.09 -64.93 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.691 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.616 ' H ' HD13 ' A' ' 30' ' ' LEU . 1.1 t70 -59.46 -21.67 60.41 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.234 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -59.8 -39.84 86.35 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.982 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.3 m-70 -63.51 -52.57 60.64 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 177.384 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.949 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -54.59 -67.31 0.28 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.684 178.328 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.807 ' O ' HG22 ' A' ' 41' ' ' ILE . 3.6 tt0 -47.41 -43.49 23.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.182 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -66.86 -25.2 66.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.546 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.982 HG23 ' O ' ' A' ' 36' ' ' HIS . 81.3 t -75.21 -39.86 43.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.218 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.807 HG22 ' O ' ' A' ' 38' ' ' GLN . 6.9 tp -43.23 -35.45 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.184 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -75.86 -40.82 53.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.192 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.792 ' OD2' HG13 ' A' ' 40' ' ' VAL . 4.2 p30 -62.14 -30.79 71.28 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.583 HG13 ' O ' ' A' ' 40' ' ' VAL . 2.3 mt -86.84 -40.55 14.14 Favored 'Isoleucine or valine' 0 C--N 1.337 0.051 0 CA-C-O 121.043 0.449 . . . . 0.0 109.972 178.31 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.406 ' NE2' HG13 ' A' ' 41' ' ' ILE . 18.6 m170 -59.39 -40.97 88.26 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.423 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -82.59 -10.02 59.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.803 178.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.533 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -87.8 -36.7 17.13 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.161 -179.847 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.48 ' HG3' ' HA2' ' A' ' 3' ' ' GLY . 10.2 ptt? -49.06 -28.8 4.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.296 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -79.07 -21.48 46.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.469 -179.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 117.29 -6.22 17.05 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.558 -0.829 . . . . 0.0 113.04 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.43 -28.62 6.66 Favored Glycine 0 C--N 1.334 0.422 0 C-N-CA 120.571 -0.823 . . . . 0.0 112.078 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -156.09 27.67 0.57 Allowed Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.521 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 25.8 p -74.0 148.37 42.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.025 0.44 . . . . 0.0 111.381 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 74.42 52.96 7.02 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 115.703 -0.681 . . . . 0.0 112.762 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 162.74 -35.03 0.33 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.386 -0.912 . . . . 0.0 113.274 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.48 ' HE2' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -88.35 -38.96 14.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.95 0.375 . . . . 0.0 111.759 -179.478 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.557 ' O ' ' HB3' ' A' ' 61' ' ' MET . 47.1 tp -60.51 -10.91 5.65 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.51 ' O ' ' HG3' ' A' ' 61' ' ' MET . 14.2 pt20 -85.74 -49.33 8.03 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.837 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.41 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 3.7 mt-10 -87.58 -28.94 21.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.95 0.405 . . . . 0.0 110.328 179.165 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.402 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -77.18 -33.92 56.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.91 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.557 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -53.64 -41.43 66.73 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.106 0.479 . . . . 0.0 110.389 179.748 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 19.1 mmtt -57.75 -24.21 55.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.939 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.651 ' HB3' HG21 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -68.75 -42.91 76.88 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.424 -179.785 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.853 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.7 p90 -69.92 -29.66 66.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.923 0.392 . . . . 0.0 110.421 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -82.41 -30.58 30.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.41 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.59 -41.25 73.1 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.605 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.96 HG13 ' CG1' ' A' ' 33' ' ' VAL . 14.6 t -56.15 -50.09 72.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.027 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 1.016 HD21 HG13 ' A' ' 85' ' ' ILE . 0.4 OUTLIER -63.13 -16.38 59.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.618 179.13 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -65.62 -61.19 2.23 Favored 'General case' 0 C--O 1.231 0.097 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.476 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -51.06 -36.59 40.74 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.906 0.86 . . . . 0.0 109.401 178.175 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.895 HD21 HG13 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -70.68 -69.11 0.38 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 113.745 -1.57 . . . . 0.0 112.336 -178.884 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.418 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 2.6 m-20 -50.25 -26.26 4.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.56 -179.247 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -88.69 9.8 23.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.506 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.625 ' O ' ' N ' ' A' ' 76' ' ' GLN . 79.0 m-70 -153.82 28.72 0.47 Allowed 'General case' 0 CA--C 1.52 -0.18 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.697 HD13 ' O ' ' A' ' 22' ' ' ASN . 0.3 OUTLIER -49.38 85.3 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.016 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.625 ' N ' ' O ' ' A' ' 74' ' ' HIS . 16.9 mm-40 -82.05 -37.74 26.0 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.052 -177.501 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -83.75 -58.07 2.32 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.223 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 174.53 121.82 0.65 Allowed Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.231 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.572 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 1.3 mtmt -42.75 -30.41 0.38 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -43.18 -35.02 1.25 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.76 0.314 . . . . 0.0 111.417 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.859 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.4 m -69.93 -74.23 0.14 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.895 HG13 HD21 ' A' ' 71' ' ' LEU . 27.3 t -48.58 -38.44 9.45 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.403 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.098 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.472 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 4.6 t60 -50.77 -41.29 56.65 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -76.2 -28.14 57.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.624 178.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 1.016 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.67 -33.6 7.79 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.14 -179.748 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.554 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -75.3 -45.42 39.9 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.801 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.466 ' O ' ' HB2' ' A' ' 91' ' ' GLU . 1.5 mp0 -59.62 -29.66 68.15 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 178.121 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.732 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.9 m-80 -82.96 -63.58 1.34 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.438 179.089 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 1.003 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -55.03 -43.77 71.12 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.22 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.468 -179.73 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -63.37 -29.32 70.65 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.133 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 87' ' ' GLN . 0.4 OUTLIER -90.39 -6.81 54.53 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.102 178.522 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.732 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -72.9 -42.25 60.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.638 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -58.47 -27.65 64.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.365 178.763 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.638 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.0 OUTLIER -62.47 -63.88 1.09 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.169 -179.222 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.653 ' HB3' HD11 ' A' ' 5' ' ' LEU . 11.8 m80 -64.21 -10.5 23.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.144 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.596 HD11 HD21 ' A' ' 9' ' ' LEU . 31.3 mt -88.52 -55.57 3.67 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.086 0.47 . . . . 0.0 110.061 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.416 ' N ' HD21 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -72.9 -7.88 53.0 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.932 178.7 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -90.96 -25.26 19.84 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.758 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.863 HD13 HD23 ' A' ' 5' ' ' LEU . 15.9 tp -70.17 -52.77 20.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.157 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 33.4 t -69.64 -27.99 35.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.423 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -77.51 -38.58 48.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.761 0.315 . . . . 0.0 110.975 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.426 ' HG3' ' CE1' ' A' ' 2' ' ' TYR . 12.6 ptp180 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.953 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpp? . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.912 0.387 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -131.49 140.42 49.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.879 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 130.35 -40.71 1.63 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.181 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.77 -16.67 61.77 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 120.567 0.222 . . . . 0.0 110.589 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 1.043 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -51.39 -23.92 4.31 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 177.878 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.512 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 23.4 t-20 -63.64 -46.51 85.36 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.612 178.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -48.62 -35.12 12.96 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.625 HD13 ' O ' ' A' ' 8' ' ' LEU . 2.5 tm? -88.07 -29.13 20.87 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.144 178.475 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.814 ' HG ' HD21 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -70.06 -33.03 71.42 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.056 0.455 . . . . 0.0 110.292 179.829 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -54.54 -40.68 68.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.235 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.459 ' HA ' ' HG2' ' A' ' 14' ' ' GLU . 0.4 OUTLIER -48.32 -43.77 33.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.931 0.396 . . . . 0.0 110.848 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.992 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -57.79 -60.53 3.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.768 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.638 ' H ' HD23 ' A' ' 12' ' ' LEU . 4.8 tp60 -51.47 -41.36 60.84 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.555 -179.129 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.459 ' HG2' ' HA ' ' A' ' 11' ' ' ASP . 10.8 pt-20 -74.21 -22.02 59.55 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.846 0.355 . . . . 0.0 110.203 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.865 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -74.21 -27.14 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.254 179.249 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.818 HD21 HD11 ' A' ' 89' ' ' ILE . 3.1 mm? -65.54 -34.62 78.68 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.356 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.82 -42.99 8.35 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 121.104 0.478 . . . . 0.0 110.247 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.668 ' HB3' HG23 ' A' ' 81' ' ' THR . 0.3 OUTLIER -68.35 -42.86 78.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.477 0.656 . . . . 0.0 109.263 178.595 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.875 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -53.66 -37.05 62.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.814 179.683 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.989 ' CE1' HD12 ' A' ' 30' ' ' LEU . 49.3 m-70 -54.04 -34.48 60.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.386 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.537 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.4 mmpt? -94.29 3.39 55.28 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -138.91 -1.43 1.79 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.94 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -72.88 -56.02 5.79 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.21 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.588 ' HB3' ' CH2' ' A' ' 23' ' ' TRP . 8.2 t-160 179.04 47.18 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.843 178.269 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 51.26 172.57 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.106 -0.569 . . . . 0.0 113.205 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.6 78.92 0.13 Allowed Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 121.012 -0.614 . . . . 0.0 112.283 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -27.05 5.52 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.95 -30.65 66.14 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.85 178.666 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -78.81 -40.51 32.77 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.989 HD12 ' CE1' ' A' ' 20' ' ' HIS . 1.1 tm? -65.97 -36.38 83.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.383 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.43 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.3 OUTLIER -46.48 -43.43 16.71 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.239 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.5 -21.3 55.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.467 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.867 HG11 HD22 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -88.3 -46.36 15.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.11 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.515 ' HB2' HD11 ' A' ' 30' ' ' LEU . 2.6 t0 -74.58 -34.33 62.86 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 179.374 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 17.6 t-20 -53.28 -29.17 31.81 Favored 'General case' 0 C--N 1.334 -0.077 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.814 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -57.05 -52.95 63.22 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.806 178.815 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.805 ' CD1' HD21 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -77.1 -32.71 56.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.826 178.825 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.592 ' O ' HG22 ' A' ' 41' ' ' ILE . 2.2 tm0? -54.96 -37.47 66.53 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -83.42 -18.3 39.18 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.952 178.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.814 HG23 ' O ' ' A' ' 36' ' ' HIS . 55.3 t -75.97 -40.81 38.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.125 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.592 HG22 ' O ' ' A' ' 38' ' ' GLN . 2.3 tp -45.53 -35.9 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.278 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.41 ' O ' ' CB ' ' A' ' 46' ' ' ASP . 0.4 OUTLIER -75.56 -28.03 58.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.561 179.546 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 1.3 m-20 -79.38 -26.32 42.01 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.737 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.636 HD11 HG12 ' A' ' 40' ' ' VAL . 2.8 mt -86.17 -57.69 4.08 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.856 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.492 ' HA ' ' HE2' ' A' ' 48' ' ' MET . 0.1 OUTLIER -58.76 -27.31 64.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.04 -179.948 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.41 ' CB ' ' O ' ' A' ' 42' ' ' GLU . 27.6 t0 -86.67 -26.36 24.35 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.568 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.9 m-85 -83.74 -52.49 6.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.273 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.509 ' SD ' HG22 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -51.97 -21.64 3.23 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.399 -179.411 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.08 16.09 10.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.348 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 102.41 31.99 5.04 Favored Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.89 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.41 ' CA ' ' HA ' ' A' ' 47' ' ' PHE . . . -111.22 24.98 14.71 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.614 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.72 25.74 9.63 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.643 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -20.02 55.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.636 0.255 . . . . 0.0 111.235 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.624 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -77.02 70.86 2.28 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.982 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.47 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . 133.64 -7.33 4.91 Favored Glycine 0 CA--C 1.518 0.223 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.953 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.926 ' NZ ' HD22 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -88.73 -37.48 15.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.669 0.271 . . . . 0.0 111.213 -179.89 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.926 HD22 ' NZ ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -63.59 -11.98 29.29 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.248 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 1.7 pp0? -86.03 -49.92 7.44 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.551 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -86.92 -30.46 21.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.753 0.311 . . . . 0.0 110.576 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.602 ' HG2' HG13 ' A' ' 40' ' ' VAL . 0.6 OUTLIER -77.88 -31.06 51.13 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.753 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.482 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -55.17 -33.82 63.3 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.896 0.379 . . . . 0.0 110.489 179.771 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 66' ' ' GLN . 31.3 tttt -67.39 -26.15 66.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.092 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.746 ' HB3' HG21 ' A' ' 40' ' ' VAL . 2.4 tp10 -70.51 -37.25 74.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.692 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.483 ' HA ' ' HB2' ' A' ' 37' ' ' LEU . 0.3 OUTLIER -85.09 -27.8 26.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.939 0.4 . . . . 0.0 110.438 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -82.45 -29.9 30.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.231 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.407 ' HB2' ' O ' ' A' ' 62' ' ' LYS . 1.1 tm0? -62.7 -36.09 81.83 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.597 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.818 HG22 ' O ' ' A' ' 33' ' ' VAL . 72.1 t -52.18 -39.97 28.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.7 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 1.06 HD21 HG13 ' A' ' 85' ' ' ILE . 1.0 OUTLIER -73.67 -5.3 39.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.004 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' A' ' 66' ' ' GLN . 2.2 m-20 -78.08 -56.38 4.52 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.507 ' CB ' HG21 ' A' ' 33' ' ' VAL . 4.8 tp10 -52.43 -32.5 39.66 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 122.029 0.919 . . . . 0.0 108.788 177.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.875 HD13 ' CG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -79.13 -64.98 1.06 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.883 -179.106 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.425 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 65.2 t30 -50.46 -24.73 3.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.748 -179.277 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -88.74 3.89 49.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.817 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.497 ' O ' ' N ' ' A' ' 76' ' ' GLN . 91.3 m-70 -147.19 26.97 1.06 Allowed 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.577 HD11 HG23 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -49.5 91.95 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.027 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 74' ' ' HIS . 13.2 tt0 -64.54 68.23 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.594 -178.054 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 56.33 29.08 56.19 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.666 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.465 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -138.96 48.92 0.84 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.385 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.536 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -55.42 -36.09 66.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.541 0.21 . . . . 0.0 111.496 -179.764 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -45.26 -32.87 2.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.636 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.668 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -69.69 -74.64 0.13 Allowed 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.158 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.849 HG13 HD21 ' A' ' 71' ' ' LEU . 38.3 t -48.83 -38.81 10.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.98 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.473 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -50.26 -41.57 50.63 Favored 'General case' 0 CA--C 1.522 -0.12 0 CA-C-O 121.145 0.498 . . . . 0.0 109.713 179.405 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -76.16 -27.21 56.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.564 178.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 1.06 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.52 -35.76 10.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.074 -179.846 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -71.24 -44.69 64.83 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.477 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -61.53 -29.05 69.75 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.729 ' O ' HD13 ' A' ' 92' ' ' ILE . 2.1 m-80 -83.01 -64.75 1.11 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.222 178.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.992 ' CG1' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -54.12 -50.85 52.01 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.41 -179.745 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.433 ' N ' HG22 ' A' ' 89' ' ' ILE . 7.2 mmmt -59.78 -29.5 68.24 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.007 -0.677 . . . . 0.0 109.725 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -90.83 -3.23 57.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.361 178.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.729 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -78.69 -40.09 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.633 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -60.01 -26.41 66.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.298 178.886 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.633 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 4.0 t60 -62.35 -65.44 0.69 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.157 -179.25 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.507 ' HB3' HD11 ' A' ' 5' ' ' LEU . 1.5 m-70 -61.7 -10.71 9.24 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.207 178.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.814 HD21 ' HG ' ' A' ' 9' ' ' LEU . 44.2 mt -89.34 -63.5 1.28 Allowed 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.943 0.401 . . . . 0.0 110.566 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -67.87 -11.77 59.32 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.324 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.421 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 0.9 OUTLIER -89.7 -13.12 37.58 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.879 179.565 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 1.043 HD13 HD23 ' A' ' 5' ' ' LEU . 10.0 tp -82.01 -56.45 3.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.016 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.624 HG11 ' HA2' ' A' ' 54' ' ' GLY . 40.9 t -66.67 -43.77 90.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.499 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -59.86 -28.33 67.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.015 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 32.7 ttt-85 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.859 179.938 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtm . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.838 0.352 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.837 ' HB3' HD11 ' A' ' 99' ' ' LEU . 25.8 m-85 -114.77 111.92 22.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.873 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -133.46 8.88 5.0 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.9 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -87.96 -19.41 27.28 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.744 0.272 . . . . 0.0 110.74 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 1.038 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -54.62 -19.3 5.76 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.728 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -61.15 -44.9 96.59 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.961 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -49.75 -28.08 5.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.045 0.45 . . . . 0.0 110.139 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.714 ' O ' HD22 ' A' ' 8' ' ' LEU . 1.2 tm? -87.64 -28.24 21.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.409 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.519 HD11 HG21 ' A' ' 44' ' ' ILE . 8.7 mt -73.18 -38.6 66.1 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.858 0.361 . . . . 0.0 110.774 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -42.83 -32.85 0.67 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.446 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.0 -52.2 13.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.519 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.917 ' O ' HG12 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -50.98 -43.2 60.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.301 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.841 ' N ' HD13 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -73.51 -38.08 65.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.626 0.251 . . . . 0.0 111.5 -179.869 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -73.89 -27.58 61.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.08 0.467 . . . . 0.0 110.132 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.917 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.9 OUTLIER -64.83 -24.34 35.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.333 179.163 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.697 HD12 HD13 ' A' ' 19' ' ' LEU . 1.1 mm? -66.49 -37.94 86.17 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.237 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.48 -33.17 1.62 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 121.172 0.511 . . . . 0.0 110.288 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.475 ' HB3' HG23 ' A' ' 81' ' ' THR . 34.3 m-80 -76.79 -45.84 27.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.903 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.971 HD21 HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -47.85 -42.61 26.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.267 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 1.033 ' CE1' HD12 ' A' ' 30' ' ' LEU . 56.3 m-70 -48.43 -42.46 32.32 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.266 -0.424 . . . . 0.0 112.035 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.444 ' HE3' ' C ' ' A' ' 20' ' ' HIS . 0.0 OUTLIER -86.24 5.01 36.33 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -177.248 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.779 ' O ' HD13 ' A' ' 75' ' ' LEU . 9.0 m-80 -146.01 12.63 1.26 Allowed 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.383 -0.527 . . . . 0.0 112.135 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.802 ' CA ' HD12 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -84.78 -33.59 22.97 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.893 179.87 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.505 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 3.1 t-160 -178.32 -51.18 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.646 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.81 138.73 2.96 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.755 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.44 104.37 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.394 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.4 tttt -53.01 -23.79 8.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.697 0.284 . . . . 0.0 110.775 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -50.91 -31.94 19.15 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.804 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -85.99 -46.91 10.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.496 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.033 HD12 ' CE1' ' A' ' 20' ' ' HIS . 2.0 tm? -60.31 -29.96 69.19 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.404 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 17.0 t-160 -45.69 -56.44 5.25 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.694 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.12 -24.1 62.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.967 0.413 . . . . 0.0 110.779 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.982 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.3 t -84.66 -66.1 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.522 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.623 ' N ' HG12 ' A' ' 33' ' ' VAL . 1.0 OUTLIER -57.87 -23.25 52.2 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.298 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.404 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 16.3 m-20 -56.97 -39.44 74.61 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 177.406 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.702 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -66.54 -45.63 78.79 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.72 -1.127 . . . . 0.0 108.028 177.366 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.992 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -56.7 -67.13 0.34 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.794 178.612 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -44.58 -41.79 6.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.056 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -62.21 -29.8 70.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.299 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.847 HG11 ' HB3' ' A' ' 64' ' ' PHE . 97.6 t -62.54 -54.82 28.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.27 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.669 HD11 HD11 ' A' ' 12' ' ' LEU . 17.3 mm -42.5 -46.13 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.938 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 1.1 pt-20 -68.02 -29.86 68.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.884 0.373 . . . . 0.0 110.405 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.546 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.9 OUTLIER -81.39 -25.2 36.45 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.921 -0.582 . . . . 0.0 109.96 178.848 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.572 HG12 ' O ' ' A' ' 40' ' ' VAL . 9.1 mm -87.17 -38.19 11.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.67 179.152 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.638 ' NE2' HG23 ' A' ' 41' ' ' ILE . 11.6 m170 -78.03 -42.3 32.93 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.633 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -72.04 -27.6 62.81 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.82 0.343 . . . . 0.0 110.47 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.546 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.8 m-85 -88.48 -45.61 9.8 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.485 ' HE1' ' N ' ' A' ' 5' ' ' LEU . 8.1 ptm -46.7 -38.16 9.45 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 120.813 0.34 . . . . 0.0 111.443 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.47 -21.33 66.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.299 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 133.05 24.93 0.69 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.945 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -102.29 35.25 5.09 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.137 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.11 32.57 4.29 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.221 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.72 ' O ' HG11 ' A' ' 100' ' ' VAL . 88.8 p -59.61 -22.48 61.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.687 0.28 . . . . 0.0 111.107 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -91.91 75.1 1.44 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.52 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 145.26 -17.14 1.9 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.619 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.476 ' HE3' ' HB2' ' A' ' 47' ' ' PHE . 2.9 pptp? -88.21 -39.97 14.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.783 0.325 . . . . 0.0 110.915 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' A' ' 96' ' ' LEU . 7.0 tp -65.85 -9.38 28.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.943 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -86.15 -50.08 7.27 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.311 -0.556 . . . . 0.0 110.696 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -87.39 -30.68 20.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.474 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.803 ' HG3' HG13 ' A' ' 40' ' ' VAL . 17.5 tpp -78.14 -33.11 50.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.163 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.528 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 2.4 tmm? -56.12 -41.97 76.12 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 120.189 -0.604 . . . . 0.0 109.843 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.04 -26.69 65.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.918 178.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.463 ' HB3' HG22 ' A' ' 40' ' ' VAL . 0.7 OUTLIER -65.27 -34.4 78.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.049 179.929 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.847 ' HB3' HG11 ' A' ' 40' ' ' VAL . 0.9 OUTLIER -87.38 -26.46 23.31 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.851 0.358 . . . . 0.0 110.606 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -82.64 -32.41 28.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.826 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -57.41 -39.3 75.87 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.202 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.992 HG21 ' HB2' ' A' ' 37' ' ' LEU . 13.0 t -50.19 -44.67 23.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.005 0.431 . . . . 0.0 110.584 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 1.034 HD11 HD13 ' A' ' 89' ' ' ILE . 0.7 OUTLIER -66.25 -13.81 60.96 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.059 179.534 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -67.84 -58.61 4.3 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.494 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 1.9 tp10 -52.81 -37.51 60.04 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 122.0 0.905 . . . . 0.0 109.486 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.871 HD21 HG13 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -72.11 -69.4 0.4 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.652 -1.613 . . . . 0.0 112.565 -178.76 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.12 -26.69 4.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.687 -179.138 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -90.97 12.4 19.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.244 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.6 ' O ' ' N ' ' A' ' 76' ' ' GLN . 79.4 m-70 -156.33 30.08 0.34 Allowed 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.779 HD13 ' O ' ' A' ' 22' ' ' ASN . 0.2 OUTLIER -50.7 85.25 0.0 OUTLIER 'General case' 0 C--O 1.232 0.157 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.89 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.6 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -81.49 -37.54 27.76 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.837 -177.637 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -82.21 -65.85 1.61 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.783 -0.722 . . . . 0.0 113.183 -179.102 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -179.12 120.12 0.68 Allowed Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.171 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.51 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -40.08 -30.71 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.672 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -44.75 -34.46 2.28 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.848 0.356 . . . . 0.0 111.263 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.699 HG21 ' HB2' ' A' ' 22' ' ' ASN . 1.8 m -68.67 -73.26 0.15 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.05 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.871 HG13 HD21 ' A' ' 71' ' ' LEU . 24.3 t -50.24 -38.8 15.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.169 179.671 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.443 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -48.83 -40.83 30.84 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.401 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -76.2 -29.46 57.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.62 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.98 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.54 -35.4 9.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.36 -179.529 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -73.79 -39.62 64.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.697 0.284 . . . . 0.0 110.248 179.316 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.418 ' O ' ' CB ' ' A' ' 91' ' ' GLU . 2.3 mp0 -67.07 -31.05 71.28 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.497 ' O ' HD13 ' A' ' 92' ' ' ILE . 2.9 m-80 -83.02 -44.24 15.44 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.594 179.26 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 1.034 HD13 HD11 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -74.1 -54.87 13.88 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.564 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.275 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.569 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 5.9 mmmt -58.56 -28.98 66.02 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.224 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.418 ' CB ' ' O ' ' A' ' 87' ' ' GLN . 2.1 tt0 -90.92 -2.62 57.71 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.561 ' HB ' ' HA ' ' A' ' 89' ' ' ILE . 1.2 tp -78.82 -49.06 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.321 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.649 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.2 OUTLIER -48.29 -26.34 1.96 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.49 179.284 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.649 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 20.6 t-80 -65.1 -66.74 0.5 Allowed 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.816 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.493 ' HB3' HD11 ' A' ' 5' ' ' LEU . 1.0 OUTLIER -60.79 -12.79 11.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.982 -0.553 . . . . 0.0 109.894 178.242 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.602 ' HB3' HD21 ' A' ' 57' ' ' LEU . 22.1 mt -86.04 -64.96 1.07 Allowed 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 120.952 0.406 . . . . 0.0 110.133 179.206 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.543 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -62.31 -16.7 55.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.789 178.694 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -86.96 2.67 48.66 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.668 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 1.038 HD13 HD23 ' A' ' 5' ' ' LEU . 16.5 tp -100.81 -63.02 1.17 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.969 0.414 . . . . 0.0 110.796 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.72 HG11 ' O ' ' A' ' 53' ' ' SER . 39.8 t -61.86 -28.73 44.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.391 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 38.2 m170 -96.59 33.63 1.8 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.021 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.874 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.0 mtp . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.787 0.327 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.551 ' HB3' HD21 ' A' ' 99' ' ' LEU . 58.9 m-85 -102.92 86.07 2.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.787 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.517 ' O ' ' HE3' ' A' ' 48' ' ' MET . . . -130.42 9.14 5.9 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.777 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 26.6 tptp -95.57 -21.17 18.43 Favored 'General case' 0 CA--C 1.507 -0.674 0 CA-C-O 120.599 0.237 . . . . 0.0 110.637 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.875 HD23 HD13 ' A' ' 99' ' ' LEU . 0.2 OUTLIER -52.04 -23.12 4.77 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.261 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.56 ' HB3' ' HE1' ' A' ' 48' ' ' MET . 26.4 p-10 -60.02 -40.18 88.42 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.569 178.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -49.84 -29.83 8.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.123 0.487 . . . . 0.0 110.027 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.617 ' C ' HD13 ' A' ' 8' ' ' LEU . 2.4 tm? -85.06 -31.25 23.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.247 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.999 HD23 HD22 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -68.3 -33.72 74.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.459 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -48.58 -45.51 38.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.324 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.413 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -57.38 -40.67 78.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.776 179.94 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.999 HD21 HD11 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -59.51 -63.4 1.32 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.747 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.89 ' HA ' HD23 ' A' ' 16' ' ' LEU . 13.0 tt0 -48.61 -41.17 30.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.617 -179.041 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -71.38 -30.12 65.76 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.101 0.477 . . . . 0.0 109.867 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.975 HG13 HG13 ' A' ' 85' ' ' ILE . 0.4 OUTLIER -66.11 -23.77 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.225 178.9 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 1.066 HD13 HD11 ' A' ' 85' ' ' ILE . 3.8 mm? -67.7 -33.92 75.86 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 177.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.422 ' HA ' ' CE ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -42.05 -42.16 2.8 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 121.189 0.518 . . . . 0.0 109.971 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.758 ' HB3' HG23 ' A' ' 81' ' ' THR . 6.4 m-20 -64.37 -49.11 72.94 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.258 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.892 HD12 HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -48.15 -57.16 6.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.719 -179.999 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 1.023 ' CE1' HD12 ' A' ' 30' ' ' LEU . 40.8 m-70 -45.25 -27.62 0.67 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.528 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.4 mmpt? -94.29 -20.09 20.1 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -177.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.477 ' O ' HD13 ' A' ' 75' ' ' LEU . 25.3 m120 -122.99 -6.25 8.43 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.997 ' CB ' HD12 ' A' ' 71' ' ' LEU . 0.2 OUTLIER -59.66 -33.28 71.34 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.894 -179.793 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.529 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 78.7 t60 -175.97 -52.65 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.566 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.5 129.35 1.73 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.844 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 71.55 115.09 0.05 OUTLIER Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.354 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -58.66 -18.61 32.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.569 0.224 . . . . 0.0 110.862 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -51.64 -38.1 53.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.627 0.251 . . . . 0.0 110.927 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -83.79 -44.63 14.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.466 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.023 HD12 ' CE1' ' A' ' 20' ' ' HIS . 1.4 tm? -62.1 -27.3 68.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.137 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.494 ' O ' ' ND2' ' A' ' 35' ' ' ASN . 0.2 OUTLIER -48.62 -36.09 15.05 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.627 179.876 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.11 -25.07 55.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.975 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.85 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.9 t -87.45 -56.67 5.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.758 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.637 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -59.02 -25.39 63.63 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.475 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.494 ' ND2' ' O ' ' A' ' 31' ' ' HIS . 0.7 OUTLIER -58.73 -40.41 83.69 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 178.145 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.885 ' O ' HG23 ' A' ' 40' ' ' VAL . 2.7 m170 -63.48 -49.78 72.27 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 177.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.042 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -55.47 -67.92 0.24 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.55 178.379 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.3 tm0? -45.68 -42.8 12.03 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.016 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -61.89 -30.69 71.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.326 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.885 HG23 ' O ' ' A' ' 36' ' ' HIS . 61.8 t -64.39 -52.69 52.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.357 179.344 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.999 HD11 HD21 ' A' ' 12' ' ' LEU . 1.5 mp -42.77 -41.15 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.722 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 0.1 OUTLIER -72.77 -28.3 62.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.925 0.393 . . . . 0.0 110.429 179.775 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.519 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 1.1 m-20 -84.03 -28.87 27.35 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.899 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.767 ' CG1' HG12 ' A' ' 40' ' ' VAL . 18.2 mm -86.67 -39.01 12.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.972 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.706 ' CE1' HG23 ' A' ' 41' ' ' ILE . 11.6 m170 -77.94 -36.55 49.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.643 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.409 ' CB ' ' O ' ' A' ' 42' ' ' GLU . 9.8 t70 -76.62 -27.67 55.81 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.67 0.271 . . . . 0.0 110.533 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.519 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 4.1 m-85 -88.35 -43.4 11.54 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.908 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.56 ' HE1' ' HB3' ' A' ' 6' ' ' ASN . 25.5 ptt? -46.6 -29.57 1.88 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.807 0.337 . . . . 0.0 111.457 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -68.61 -28.11 66.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.105 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 141.21 -12.5 2.8 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.875 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -55.13 -22.63 29.61 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.716 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 155.21 55.0 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.281 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.478 ' OG ' HG22 ' A' ' 100' ' ' VAL . 1.2 t -76.17 -20.16 57.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.601 0.239 . . . . 0.0 111.39 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.8 74.03 2.11 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.542 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 145.6 -17.52 1.84 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.637 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.452 ' O ' ' CB ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.18 -43.08 11.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.673 0.273 . . . . 0.0 111.086 179.893 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.51 ' O ' ' CB ' ' A' ' 61' ' ' MET . 44.9 tp -64.34 -10.29 23.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.739 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -85.97 -49.75 7.6 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.853 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -87.14 -30.13 21.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.343 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.642 ' HG3' HG13 ' A' ' 40' ' ' VAL . 3.7 tpt -78.11 -31.39 49.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.861 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.51 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -56.16 -39.01 71.65 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.315 179.714 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.69 -11.57 60.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.144 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -84.82 -26.25 27.57 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.46 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.478 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.4 p90 -87.19 -28.81 22.19 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.749 0.309 . . . . 0.0 110.92 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.38 -30.28 30.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.701 179.519 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -30.7 67.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.825 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 1.042 HG21 ' HB2' ' A' ' 37' ' ' LEU . 24.3 t -57.43 -59.87 2.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.566 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 1.071 HD11 HD13 ' A' ' 89' ' ' ILE . 1.7 mp -61.04 -13.7 18.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.369 178.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -66.82 -52.28 45.63 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.47 ' CG ' ' CZ3' ' A' ' 23' ' ' TRP . 0.2 OUTLIER -58.62 -33.63 70.25 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.76 0.79 . . . . 0.0 108.941 177.69 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.997 HD12 ' CB ' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -63.76 -65.91 0.62 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.265 -1.334 . . . . 0.0 111.851 -179.516 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.522 ' HA ' HD23 ' A' ' 75' ' ' LEU . 15.1 t30 -49.77 -23.91 2.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.708 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -85.24 -3.51 58.84 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 33.4 m-70 -150.92 36.49 0.62 Allowed 'General case' 0 CA--C 1.52 -0.188 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.854 HD21 HG22 ' A' ' 82' ' ' VAL . 0.5 OUTLIER -67.46 85.35 0.17 Allowed 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.343 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -68.03 65.75 0.1 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.97 -178.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.94 54.41 21.73 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.463 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.586 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -154.15 28.67 0.72 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.577 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.428 ' HE3' ' HG ' ' A' ' 75' ' ' LEU . 5.1 mmpt? -43.11 -27.35 0.21 Allowed 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 22.8 p80 -57.5 -41.22 80.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.162 0.506 . . . . 0.0 110.514 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.776 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.4 m -58.65 -52.35 66.06 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.156 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.951 HG13 ' CD2' ' A' ' 71' ' ' LEU . 0.2 OUTLIER -57.95 -60.05 2.67 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.529 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.55 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.47 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 60.8 t-80 -42.88 -40.02 2.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.877 0.37 . . . . 0.0 110.485 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -76.28 -49.05 18.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.177 179.143 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 1.066 HD11 HD13 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -75.34 -16.74 15.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.723 -179.231 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.618 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -93.08 -44.1 8.55 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 179.196 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 1.1 mp0 -62.69 -23.94 67.39 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 177.346 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.702 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.3 m-80 -82.73 -59.49 2.49 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 114.491 -1.231 . . . . 0.0 110.07 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 1.071 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -65.07 -49.68 78.24 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.35 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.453 -179.743 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.463 ' N ' HG22 ' A' ' 89' ' ' ILE . 1.3 tptp -58.47 -27.33 64.3 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.494 -0.482 . . . . 0.0 109.941 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -90.7 -4.69 56.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.25 178.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.702 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.0 OUTLIER -78.65 -48.02 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 179.525 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.627 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.2 OUTLIER -48.06 -28.21 2.72 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.456 179.16 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.627 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 34.0 t-80 -62.6 -63.51 1.2 Allowed 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.986 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.542 ' O ' HD21 ' A' ' 5' ' ' LEU . 22.8 m-70 -65.8 -9.17 26.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.182 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 19.3 mt -89.19 -59.87 2.1 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 120.982 0.42 . . . . 0.0 110.149 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.465 ' N ' HD21 ' A' ' 57' ' ' LEU . 87.2 mt-10 -69.0 -12.47 61.71 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.851 178.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -85.97 -22.51 27.32 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.625 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.875 HD13 HD23 ' A' ' 5' ' ' LEU . 27.8 tp -75.29 -60.47 2.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.896 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.478 HG22 ' OG ' ' A' ' 53' ' ' SER . 21.6 t -59.88 -41.09 84.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.389 -179.64 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.4 -30.56 70.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.919 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.824 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 ttm . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.867 0.365 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.747 ' CG ' HD11 ' A' ' 99' ' ' LEU . 5.0 m-85 -147.72 86.33 1.59 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -116.37 -14.28 7.71 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.725 -0.75 . . . . 0.0 113.024 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.82 -19.78 61.26 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 116.758 0.279 . . . . 0.0 111.193 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 1.041 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -51.93 -23.34 4.85 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.177 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.491 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 16.5 t-20 -65.53 -36.26 83.29 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.766 179.001 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -48.5 -35.79 13.85 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.629 HD13 ' C ' ' A' ' 8' ' ' LEU . 2.4 tm? -88.25 -29.0 20.75 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.093 178.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.746 ' HG ' HD21 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -71.83 -27.01 62.62 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 120.825 0.345 . . . . 0.0 110.619 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -58.55 -46.23 87.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.269 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -46.59 -39.03 10.42 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.985 0.422 . . . . 0.0 111.201 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.978 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -58.53 -61.47 2.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.663 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.73 ' N ' HD23 ' A' ' 12' ' ' LEU . 1.8 tt0 -52.19 -34.9 47.45 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.791 -179.338 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.33 -29.7 53.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.889 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.811 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -65.05 -34.52 71.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.834 179.104 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.796 ' CD1' HD13 ' A' ' 19' ' ' LEU . 3.8 mm? -57.13 -36.59 70.88 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.072 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.76 -45.08 4.66 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.127 0.489 . . . . 0.0 110.329 179.075 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.485 ' HB3' HG23 ' A' ' 81' ' ' THR . 59.3 m-80 -67.32 -44.42 79.19 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.324 178.574 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.879 HD12 HD22 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -52.82 -35.6 57.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.065 179.791 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.908 ' CE1' HD12 ' A' ' 30' ' ' LEU . 26.7 m-70 -55.18 -31.66 61.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.641 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.495 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 6.4 mmpt? -94.38 -4.59 48.18 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -178.01 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.598 ' HB2' HG21 ' A' ' 81' ' ' THR . 3.5 m-80 -128.06 -13.82 5.04 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.028 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.974 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.65 -38.47 84.96 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.573 -179.916 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.495 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 33.3 t60 -175.2 -48.66 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.861 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 143.28 126.6 2.04 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.409 -0.9 . . . . 0.0 112.819 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 88.02 100.13 0.92 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.316 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.38 -26.03 4.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.717 0.294 . . . . 0.0 110.566 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -55.63 -30.02 60.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.507 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -86.97 -35.19 19.0 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.436 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.974 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.2 tm? -71.86 -32.87 67.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.874 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -50.38 -36.24 31.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.846 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.72 -25.96 54.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.551 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.862 ' O ' HG22 ' A' ' 67' ' ' VAL . 2.8 p -89.8 -48.84 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.26 -179.577 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.57 ' HB2' HD11 ' A' ' 30' ' ' LEU . 2.3 t70 -69.08 -23.75 64.06 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -54.05 -36.14 62.76 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.186 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.769 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -62.85 -33.52 75.43 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.309 178.385 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.859 HD11 HD21 ' A' ' 12' ' ' LEU . 0.1 OUTLIER -74.51 -64.25 1.07 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.24 179.184 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.72 ' O ' HG22 ' A' ' 41' ' ' ILE . 3.3 tt0 -46.23 -31.54 2.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.39 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.43 -28.51 59.38 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.919 0.39 . . . . 0.0 110.376 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.769 HG23 ' O ' ' A' ' 36' ' ' HIS . 53.3 t -73.4 -46.42 49.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.659 179.537 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.72 HG22 ' O ' ' A' ' 38' ' ' GLN . 2.7 tp -45.47 -34.72 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.386 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.459 ' O ' ' HB2' ' A' ' 46' ' ' ASP . 1.4 mt-10 -75.65 -30.95 59.62 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.646 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.528 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -82.8 -25.69 32.48 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.875 178.754 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.581 HG21 HD11 ' A' ' 9' ' ' LEU . 31.0 mm -87.29 -47.53 15.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.678 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.563 ' CE1' ' OD1' ' A' ' 46' ' ' ASP . 0.1 OUTLIER -70.97 -26.9 63.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.865 -178.957 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.563 ' OD1' ' CE1' ' A' ' 45' ' ' HIS . 69.3 m-20 -86.65 -40.72 14.84 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.07 0.462 . . . . 0.0 110.302 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.528 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 4.3 m-85 -72.3 -40.94 67.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.216 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.473 ' HE3' ' HA ' ' A' ' 45' ' ' HIS . 16.7 ptp -53.29 -26.9 20.23 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.817 0.341 . . . . 0.0 111.072 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -79.71 -1.4 38.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.436 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 120.04 18.38 4.27 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.863 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.403 ' O ' ' CD2' ' A' ' 47' ' ' PHE . . . -95.97 28.1 13.99 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.453 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.27 38.98 3.86 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.448 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.1 p -62.45 -25.68 68.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.773 0.321 . . . . 0.0 111.182 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.42 70.92 3.01 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.531 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.413 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . 150.19 -20.86 1.09 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.798 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.478 ' O ' ' CB ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.44 -46.0 9.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.618 0.246 . . . . 0.0 111.473 -179.814 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.631 HD21 ' HB3' ' A' ' 96' ' ' LEU . 13.7 tp -62.6 -9.28 8.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.301 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 61' ' ' MET . 16.9 pt20 -86.2 -50.83 6.69 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.815 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 17.4 mm-40 -87.66 -28.31 21.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.951 0.405 . . . . 0.0 110.302 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.592 ' CG ' HG13 ' A' ' 40' ' ' VAL . 9.3 tpp -78.23 -33.15 50.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.042 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.554 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 3.8 ptt? -55.44 -38.99 69.73 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.547 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 66' ' ' GLN . 0.3 OUTLIER -65.62 -15.57 62.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.898 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.491 ' HB3' HG21 ' A' ' 40' ' ' VAL . 75.0 tt0 -79.32 -25.4 42.35 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.732 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.555 ' HA ' HD22 ' A' ' 37' ' ' LEU . 2.0 p90 -86.95 -35.39 18.91 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.903 0.382 . . . . 0.0 110.467 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.478 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 0.0 OUTLIER -74.47 -31.2 62.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.545 179.294 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 62' ' ' LYS . 11.6 tt0 -57.91 -33.99 69.35 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.505 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.862 HG22 ' O ' ' A' ' 33' ' ' VAL . 72.0 t -58.09 -47.09 87.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.079 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 1.022 HD11 HD13 ' A' ' 89' ' ' ILE . 1.3 mp -65.31 -14.68 61.33 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.269 178.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -66.37 -62.02 1.69 Allowed 'General case' 0 C--O 1.231 0.094 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HB3' HG21 ' A' ' 33' ' ' VAL . 14.4 tp10 -50.82 -32.1 19.1 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.787 0.804 . . . . 0.0 109.314 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.879 HD22 HD12 ' A' ' 19' ' ' LEU . 0.4 OUTLIER -74.52 -69.41 0.46 Allowed 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 113.979 -1.464 . . . . 0.0 112.232 -178.939 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.411 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 1.5 t-20 -49.49 -26.3 3.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.702 -179.203 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.64 6.26 28.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.557 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.593 ' O ' ' N ' ' A' ' 76' ' ' GLN . 66.6 m-70 -152.15 32.71 0.53 Allowed 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.746 HD21 HG21 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -54.65 83.28 0.0 OUTLIER 'General case' 0 CA--C 1.521 -0.135 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.789 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.593 ' N ' ' O ' ' A' ' 74' ' ' HIS . 1.0 OUTLIER -83.9 -34.07 24.62 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.947 -177.425 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -83.85 -66.45 1.49 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.615 -0.802 . . . . 0.0 113.062 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -174.35 116.88 0.6 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.115 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.57 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -44.28 -29.78 0.71 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.634 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -45.58 -30.81 1.6 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.838 0.352 . . . . 0.0 111.032 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.598 HG21 ' HB2' ' A' ' 22' ' ' ASN . 1.2 m -69.93 -74.4 0.14 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.851 HG13 HD21 ' A' ' 71' ' ' LEU . 22.2 t -48.92 -40.88 12.8 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.384 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.034 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.471 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -48.97 -41.31 33.78 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.089 0.471 . . . . 0.0 109.737 179.541 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.433 ' O ' ' HB3' ' A' ' 88' ' ' ASN . 0.6 OUTLIER -76.25 -27.58 56.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.696 178.865 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.997 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.61 -36.16 10.48 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.165 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.151 -179.611 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.471 ' CG ' ' HA ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -71.93 -43.68 64.88 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.213 -0.292 . . . . 0.0 110.213 179.433 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -62.41 -29.46 70.51 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.715 ' OD1' HG11 ' A' ' 15' ' ' VAL . 0.1 OUTLIER -82.92 -57.3 3.35 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.305 179.122 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 1.022 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -61.56 -48.23 89.73 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.374 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.97 -179.616 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.454 ' N ' HG22 ' A' ' 89' ' ' ILE . 20.6 tptp -61.46 -28.57 69.38 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 120.291 -0.564 . . . . 0.0 109.494 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -90.73 -2.24 57.82 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.094 178.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.7 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.0 OUTLIER -78.62 -43.27 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.355 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.637 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -54.97 -26.64 37.98 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.149 178.692 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.637 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.1 OUTLIER -62.87 -65.73 0.64 Allowed 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.84 -179.523 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.576 ' HB3' HD11 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -60.15 -12.1 7.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.108 178.378 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.746 HD21 ' HG ' ' A' ' 9' ' ' LEU . 55.5 mt -89.29 -65.7 0.99 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.529 179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.466 ' HA ' HD23 ' A' ' 57' ' ' LEU . 4.2 mm-40 -63.09 -16.36 59.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.17 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 94' ' ' HIS . 56.6 tt0 -87.83 -10.73 49.95 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.745 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 1.041 HD13 HD23 ' A' ' 5' ' ' LEU . 30.0 tp -81.4 -57.18 3.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.644 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 41.1 t -62.35 -31.13 50.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.276 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -69.4 -40.61 77.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.919 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.293 -0.861 . . . . 0.0 110.921 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.8 mmt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.785 0.326 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -73.65 123.17 23.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.977 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -179.83 -34.65 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.488 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 tptm -59.96 -17.44 38.09 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 116.611 0.205 . . . . 0.0 110.928 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.744 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -49.27 -25.56 2.43 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.111 -0.699 . . . . 0.0 109.111 178.041 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -59.29 -41.2 88.39 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.832 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -50.42 -31.45 15.04 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.204 0.526 . . . . 0.0 110.001 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.669 ' O ' HD13 ' A' ' 8' ' ' LEU . 2.8 tm? -83.49 -30.61 27.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.024 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.668 ' HB3' HD11 ' A' ' 41' ' ' ILE . 8.8 mt -60.79 -42.78 98.25 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.555 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -45.5 -40.05 8.05 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.487 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.421 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 5.4 m-20 -54.65 -43.02 72.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.987 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.972 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -56.57 -63.36 1.22 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.534 179.805 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.775 ' HA ' HD23 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -52.41 -37.77 57.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.314 -179.14 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -75.18 -26.73 59.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.941 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.892 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -68.89 -28.52 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.09 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 1.015 HD12 HD13 ' A' ' 19' ' ' LEU . 1.6 mm? -67.48 -34.63 77.55 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.312 179.105 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 ttpp -40.45 -33.94 0.3 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.151 0.501 . . . . 0.0 110.515 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.888 ' HB3' HG23 ' A' ' 81' ' ' THR . 2.2 m-20 -81.18 -41.53 22.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.905 178.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 1.015 HD13 HD12 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -51.72 -29.93 20.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.128 179.722 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.972 ' CE1' HD12 ' A' ' 30' ' ' LEU . 76.2 m-70 -62.19 -37.51 85.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.021 0.439 . . . . 0.0 110.836 -179.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.545 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 4.3 mmpt? -94.5 16.85 14.29 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.034 -178.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.497 ' HB2' HG21 ' A' ' 81' ' ' THR . 7.6 m-80 -145.41 -20.12 0.48 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -179.031 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.967 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -63.75 -27.66 69.35 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 119.719 -0.793 . . . . 0.0 110.959 -179.608 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.46 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 86.2 t60 -178.86 -53.13 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.889 0.376 . . . . 0.0 110.643 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 141.68 126.83 2.2 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.874 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 90.9 94.63 1.26 Allowed Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.107 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.82 -26.65 1.72 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.753 0.311 . . . . 0.0 110.591 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -53.8 -32.25 51.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.484 179.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -86.25 -42.37 13.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.329 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.972 HD12 ' CE1' ' A' ' 20' ' ' HIS . 1.5 tm? -62.05 -35.89 79.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.838 179.076 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.468 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 45.3 t60 -46.61 -35.35 5.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.404 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.61 -24.1 53.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.689 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.892 ' O ' HG22 ' A' ' 67' ' ' VAL . 2.7 p -91.87 -47.17 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.438 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.662 ' HB2' HD11 ' A' ' 30' ' ' LEU . 6.7 t70 -71.63 -23.98 61.79 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.086 179.165 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.468 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 11.3 t30 -54.33 -30.69 52.18 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.188 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.741 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -69.0 -32.21 71.6 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.851 178.569 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.821 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -75.39 -64.52 1.05 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.434 179.427 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.747 ' O ' HG22 ' A' ' 41' ' ' ILE . 1.5 pt20 -47.08 -28.53 1.76 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.298 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -76.33 -28.36 56.87 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.91 0.386 . . . . 0.0 110.351 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.741 HG23 ' O ' ' A' ' 36' ' ' HIS . 78.6 t -75.92 -43.3 39.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.504 179.337 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.747 HG22 ' O ' ' A' ' 38' ' ' GLN . 4.7 tp -46.5 -33.11 1.84 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.13 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.056 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -75.57 -30.59 59.72 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.081 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.597 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 43.2 m-20 -82.79 -25.41 32.76 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.835 178.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.789 HD13 ' HE2' ' A' ' 56' ' ' LYS . 17.1 mm -86.9 -53.05 10.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.098 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -64.58 -27.71 69.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.23 -179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -86.63 -46.8 9.75 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 120.907 0.384 . . . . 0.0 110.501 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.597 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.5 m-30 -66.5 -23.24 66.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.567 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.407 ' HE3' HD22 ' A' ' 96' ' ' LEU . 0.0 OUTLIER -52.8 -26.01 13.11 Favored 'General case' 0 C--N 1.334 -0.109 0 CA-C-O 120.888 0.375 . . . . 0.0 110.635 179.427 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -90.9 9.45 30.36 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.367 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.58 -2.15 58.75 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.694 -0.765 . . . . 0.0 113.082 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.36 -41.28 31.84 Favored Glycine 0 C--N 1.333 0.39 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.167 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.442 ' HA3' ' CE2' ' A' ' 47' ' ' PHE . . . -163.74 24.73 0.19 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.178 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.59 -168.32 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.883 0.373 . . . . 0.0 110.764 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.651 ' H ' HG11 ' A' ' 100' ' ' VAL . . . 88.65 -62.02 3.76 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.77 -0.728 . . . . 0.0 113.041 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.434 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . -124.57 11.55 7.96 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.386 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.789 ' HE2' HD13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -88.43 -44.23 10.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 117.034 0.417 . . . . 0.0 111.249 179.858 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.72 HD22 ' NZ ' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -59.32 -14.09 10.32 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.872 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 55' ' ' GLY . 27.1 pt20 -85.9 -50.62 6.96 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.34 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -85.87 -29.81 23.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.864 0.364 . . . . 0.0 110.655 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.645 ' HG2' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -78.3 -31.78 49.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.995 179.796 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.517 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 0.1 OUTLIER -56.86 -40.47 76.21 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.489 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.97 -19.44 61.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.929 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.536 ' HB3' HG21 ' A' ' 40' ' ' VAL . 18.7 tt0 -76.46 -31.86 58.06 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.543 -179.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.577 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.1 p90 -87.04 -25.86 24.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.88 0.371 . . . . 0.0 110.456 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -82.13 -30.96 30.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.417 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -58.48 -36.7 74.14 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.416 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.892 HG22 ' O ' ' A' ' 33' ' ' VAL . 83.4 t -54.19 -42.89 58.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.422 179.141 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 1.096 HD21 HG13 ' A' ' 85' ' ' ILE . 0.5 OUTLIER -74.09 -14.28 60.96 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.512 179.142 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.67 -52.19 53.53 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.417 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 5.5 tp10 -57.65 -24.57 57.26 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.528 0.68 . . . . 0.0 109.709 178.364 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 1.019 HD23 HG22 ' A' ' 82' ' ' VAL . 0.9 OUTLIER -70.45 -65.27 0.75 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.734 -1.121 . . . . 0.0 112.818 -178.826 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -46.53 -21.7 0.21 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.418 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.407 ' N ' ' C ' ' A' ' 71' ' ' LEU . 45.7 m-20 -83.56 -23.85 31.84 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.135 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.53 ' CB ' ' O ' ' A' ' 23' ' ' TRP . 44.1 m-70 -135.94 33.2 2.91 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 119.234 -0.986 . . . . 0.0 112.993 -179.257 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.64 ' CD2' HG21 ' A' ' 82' ' ' VAL . 0.0 OUTLIER -51.92 92.08 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 177.587 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.484 ' N ' ' O ' ' A' ' 74' ' ' HIS . 41.9 tp60 -64.3 69.14 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.55 -178.017 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 52.74 25.49 22.4 Favored Glycine 0 N--CA 1.453 -0.176 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.716 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -126.7 40.01 1.87 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.426 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.439 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -48.9 -31.47 7.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.638 0.256 . . . . 0.0 111.215 -179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -58.25 -31.72 67.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.042 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.888 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -68.02 -74.56 0.12 Allowed 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 1.019 HG22 HD23 ' A' ' 71' ' ' LEU . 12.6 t -49.09 -40.93 13.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.95 179.594 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.48 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 7.0 m170 -49.33 -41.86 39.86 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.189 0.519 . . . . 0.0 109.776 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -76.27 -27.07 56.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.622 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 1.096 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.25 -36.34 10.94 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.9 -179.865 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -71.11 -45.82 62.89 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.164 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.459 ' NE2' ' OE2' ' A' ' 86' ' ' GLU . 1.2 mp0 -59.04 -29.74 67.52 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.732 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.8 m-80 -82.96 -67.61 0.77 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.505 179.147 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.972 ' CG1' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -52.84 -47.83 51.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.511 -179.591 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.427 ' N ' HG22 ' A' ' 89' ' ' ILE . 0.1 OUTLIER -62.3 -29.26 70.31 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.28 -0.568 . . . . 0.0 109.662 179.647 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -90.78 -4.0 56.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.168 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.732 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -78.58 -44.59 25.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.628 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -52.39 -29.19 22.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.536 179.149 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.628 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 38.1 t-80 -61.57 -65.36 0.7 Allowed 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.109 -179.262 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.433 ' HB3' HD11 ' A' ' 5' ' ' LEU . 40.9 m170 -62.44 -9.56 8.82 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.369 178.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.503 HD11 HD21 ' A' ' 9' ' ' LEU . 30.9 mt -89.3 -63.46 1.29 Allowed 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 120.956 0.408 . . . . 0.0 110.456 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -67.56 -12.25 59.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.219 179.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 94' ' ' HIS . 11.2 mm-40 -87.92 -26.42 22.72 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 120.912 0.386 . . . . 0.0 110.377 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.744 HD13 HD23 ' A' ' 5' ' ' LEU . 11.3 tp -66.83 -56.84 8.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.92 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.651 HG11 ' H ' ' A' ' 54' ' ' GLY . 31.9 t -63.56 -39.94 87.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.423 -179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -60.9 -33.04 72.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.837 0.351 . . . . 0.0 111.006 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.838 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 ptp . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.796 0.331 . . . . 0.0 111.204 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.567 ' O ' HD21 ' A' ' 99' ' ' LEU . 48.7 m-85 -99.32 54.61 0.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.889 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -119.53 -25.74 2.56 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.84 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -63.2 -17.63 62.62 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.61 0.205 . . . . 0.0 111.105 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.803 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -51.17 -24.02 3.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.046 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.412 ' N ' ' CE ' ' A' ' 48' ' ' MET . 33.6 p-10 -59.61 -41.13 89.66 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.896 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -48.24 -32.59 7.4 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.22 0.533 . . . . 0.0 110.048 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.618 ' C ' HD13 ' A' ' 8' ' ' LEU . 2.5 tm? -87.4 -30.3 20.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.295 179.314 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.835 ' HG ' HD21 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -68.92 -34.94 76.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.359 179.799 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -52.96 -43.06 66.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.302 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.41 -41.31 28.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.927 0.394 . . . . 0.0 111.001 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.007 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -57.36 -61.22 2.63 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.6 179.833 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.724 ' H ' HD23 ' A' ' 12' ' ' LEU . 7.5 tm0? -51.28 -38.04 50.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.047 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -75.67 -28.47 58.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.905 179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.818 HG13 ' HB ' ' A' ' 85' ' ' ILE . 0.3 OUTLIER -68.18 -31.08 50.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.983 179.19 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.759 ' CD1' HD13 ' A' ' 19' ' ' LEU . 3.4 mm? -60.5 -37.38 80.92 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.207 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.2 ttpt -41.78 -41.91 2.48 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.033 0.444 . . . . 0.0 110.554 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.752 ' HB3' HG23 ' A' ' 81' ' ' THR . 0.8 OUTLIER -70.9 -43.77 67.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.759 178.729 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.887 HD12 HD22 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -50.42 -44.0 55.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.572 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 1.058 ' CE1' HD12 ' A' ' 30' ' ' LEU . 78.5 m-70 -49.33 -31.3 8.96 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.502 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 6.2 mmpt? -94.24 -9.86 34.79 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -177.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.634 ' HB2' HG21 ' A' ' 81' ' ' THR . 4.8 m120 -126.37 3.82 6.99 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -179.523 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.779 ' CB ' HD12 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -77.06 -54.05 7.03 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.752 179.833 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.524 ' HB3' ' CZ2' ' A' ' 23' ' ' TRP . 8.7 t-160 179.39 57.6 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.921 0.391 . . . . 0.0 111.027 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 118.21 -107.5 1.48 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.302 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -124.65 -146.2 6.81 Favored Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.167 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.454 ' CD ' ' CE1' ' A' ' 20' ' ' HIS . 17.3 ttpp -94.11 -11.13 31.18 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -50.41 -65.45 0.56 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -178.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -75.14 -25.39 58.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.567 0.222 . . . . 0.0 111.111 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.058 HD12 ' CE1' ' A' ' 20' ' ' HIS . 2.0 tm? -72.99 -29.15 62.82 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.432 ' N ' ' O ' ' A' ' 27' ' ' LYS . 10.2 t-80 -47.71 -51.85 20.51 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.527 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.11 -22.48 66.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.887 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.955 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.2 t -85.82 -62.25 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.864 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.591 ' H ' HD13 ' A' ' 30' ' ' LEU . 1.3 t0 -59.42 -25.26 64.18 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -56.41 -39.42 72.99 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 177.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.736 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -65.13 -45.85 83.39 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 177.444 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.965 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -53.51 -69.69 0.11 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.619 178.623 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.855 ' O ' HG22 ' A' ' 41' ' ' ILE . 1.6 mt-30 -46.48 -43.55 16.79 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.038 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -54.99 -26.22 35.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.05 0.452 . . . . 0.0 110.243 179.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.736 HG23 ' O ' ' A' ' 36' ' ' HIS . 32.5 t -74.36 -57.52 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.374 179.274 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.855 HG22 ' O ' ' A' ' 38' ' ' GLN . 0.5 OUTLIER -44.49 -35.71 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.79 -179.766 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.428 ' HA ' ' ND1' ' A' ' 45' ' ' HIS . 3.8 pt-20 -75.64 -30.29 59.41 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.829 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.517 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 2.1 m-20 -84.08 -27.56 28.17 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.885 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.584 HG22 ' SD ' ' A' ' 48' ' ' MET . 25.3 mm -86.99 -48.43 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.497 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.428 ' ND1' ' HA ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -68.96 -26.83 65.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.276 -179.631 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -86.48 -41.91 14.0 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.071 0.463 . . . . 0.0 110.226 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.517 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.4 m-85 -72.14 -23.72 61.34 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.606 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.584 ' SD ' HG22 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -54.01 -34.6 60.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.981 179.752 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -73.77 -22.46 59.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.422 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 146.14 -11.8 1.61 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.428 -0.892 . . . . 0.0 113.082 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.36 -26.44 4.97 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.71 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 154.03 44.61 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.256 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.661 ' OG ' HG22 ' A' ' 100' ' ' VAL . 1.8 t -59.53 -29.65 68.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.731 0.3 . . . . 0.0 111.03 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.23 72.03 2.05 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.191 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.464 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . 149.03 -19.79 1.23 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.575 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.492 ' CD ' HD13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -88.64 -46.01 9.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.663 0.268 . . . . 0.0 111.279 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.795 HD11 ' HB3' ' A' ' 96' ' ' LEU . 5.7 tp -61.79 -10.84 9.95 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.464 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 1.6 pp0? -85.88 -50.98 6.69 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.939 179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -86.88 -30.8 21.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.997 0.427 . . . . 0.0 110.382 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.729 ' HG3' HG13 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -76.39 -29.52 57.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.616 179.637 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.508 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 2.9 tmm? -55.66 -44.69 77.47 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 121.015 0.436 . . . . 0.0 110.509 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -12.82 60.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.181 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.42 ' HB3' HG22 ' A' ' 40' ' ' VAL . 28.2 tt0 -83.2 -24.75 32.28 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.535 -179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.491 ' HB3' HG11 ' A' ' 40' ' ' VAL . 1.6 p90 -87.08 -35.38 18.74 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.902 0.382 . . . . 0.0 110.427 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.458 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 0.0 OUTLIER -79.17 -30.97 43.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.96 179.757 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -58.92 -34.93 72.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.019 0.438 . . . . 0.0 110.407 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.965 HG21 ' HB2' ' A' ' 37' ' ' LEU . 80.5 t -57.65 -44.05 84.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.418 179.417 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 1.033 HD11 HD13 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.44 -9.21 55.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.611 178.799 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -71.45 -57.99 3.92 Favored 'General case' 0 C--O 1.231 0.098 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.589 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 3.5 tp10 -53.38 -37.48 62.47 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.949 0.88 . . . . 0.0 108.996 177.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.887 HD22 HD12 ' A' ' 19' ' ' LEU . 0.3 OUTLIER -70.86 -68.34 0.44 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.72 -1.582 . . . . 0.0 112.04 -179.32 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.411 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 22.5 t30 -49.3 -25.59 2.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.924 -179.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -85.28 4.17 36.15 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.656 ' O ' ' N ' ' A' ' 76' ' ' GLN . 72.2 m-70 -150.9 32.03 0.62 Allowed 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.597 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -50.27 82.76 0.0 OUTLIER 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.912 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.656 ' N ' ' O ' ' A' ' 74' ' ' HIS . 5.4 tt0 -84.18 -34.32 24.0 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.675 -177.512 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -88.1 -20.34 49.91 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.7 -0.762 . . . . 0.0 113.009 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.512 ' C ' HD12 ' A' ' 75' ' ' LEU . . . 130.82 130.24 3.16 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.256 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.597 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -52.76 -19.44 2.45 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -179.824 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -48.6 -39.24 23.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.696 0.284 . . . . 0.0 111.32 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.752 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -69.55 -74.15 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 178.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.872 HG13 HD21 ' A' ' 71' ' ' LEU . 25.8 t -47.77 -36.8 5.5 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.414 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.084 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.474 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 57.0 t-80 -52.45 -41.08 62.97 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -76.17 -28.26 57.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.459 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.987 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.61 -33.15 7.45 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.196 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.054 -179.728 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.575 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -75.95 -44.69 38.74 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.059 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -60.85 -29.97 69.84 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.053 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.716 ' O ' HD13 ' A' ' 92' ' ' ILE . 2.0 m-80 -82.89 -63.19 1.41 Allowed 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.065 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 1.033 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -54.5 -48.51 69.79 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.186 179.959 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.45 ' N ' HG22 ' A' ' 89' ' ' ILE . 0.1 OUTLIER -60.88 -29.55 69.62 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.6 179.658 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -90.8 -3.44 57.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.371 178.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.716 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -78.65 -39.05 22.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.62 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -60.45 -25.07 65.72 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.25 178.689 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.62 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 8.9 t-80 -60.56 -65.91 0.61 Allowed 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.222 -179.109 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.601 ' HB3' HD11 ' A' ' 5' ' ' LEU . 63.7 m80 -63.67 -9.32 13.36 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.48 178.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.835 HD21 ' HG ' ' A' ' 9' ' ' LEU . 55.2 mt -89.48 -59.7 2.14 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.127 0.489 . . . . 0.0 110.543 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.422 ' HA ' ' CD2' ' A' ' 57' ' ' LEU . 5.4 mt-10 -66.61 -11.96 55.83 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.382 179.011 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.533 ' HB2' ' O ' ' A' ' 94' ' ' HIS . 8.8 tt0 -94.68 3.71 54.73 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.723 0.297 . . . . 0.0 111.111 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.803 HD13 HD23 ' A' ' 5' ' ' LEU . 8.1 tp -101.66 -47.48 4.62 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.966 0.412 . . . . 0.0 110.669 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.661 HG22 ' OG ' ' A' ' 53' ' ' SER . 41.2 t -76.89 -34.12 22.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.124 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -98.33 31.33 2.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.943 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.6 tpt85 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.958 179.98 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 tpp . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.79 0.328 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -92.38 137.8 32.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.866 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.518 ' HA2' ' HG3' ' A' ' 48' ' ' MET . . . 157.6 -23.14 0.42 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.581 -0.819 . . . . 0.0 112.99 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.45 -18.62 61.68 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 116.654 0.227 . . . . 0.0 111.056 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.891 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -53.14 -21.76 5.42 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.061 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.595 ' HA ' HD12 ' A' ' 9' ' ' LEU . 38.5 p-10 -61.39 -40.18 93.4 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.815 179.176 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -51.38 -28.44 12.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.086 0.469 . . . . 0.0 110.012 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.814 ' O ' HD22 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -83.86 -29.38 27.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.002 179.22 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.813 ' O ' HD23 ' A' ' 12' ' ' LEU . 10.3 mt -63.79 -30.61 71.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.049 0.452 . . . . 0.0 110.792 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -54.46 -51.28 65.52 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.549 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -51.25 -49.55 60.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.885 0.374 . . . . 0.0 111.33 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.044 HD21 HD11 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -56.51 -60.82 2.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.615 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.615 ' HA ' HD23 ' A' ' 16' ' ' LEU . 2.4 tt0 -53.85 -35.28 61.31 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.037 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -77.98 -26.03 48.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.228 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.848 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -70.5 -27.56 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.401 179.314 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.676 HD12 HD22 ' A' ' 19' ' ' LEU . 3.0 mm? -61.1 -36.66 80.28 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.313 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.562 ' HA ' ' CD2' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -48.68 -40.54 28.52 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.105 0.479 . . . . 0.0 110.096 179.478 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.92 -39.17 76.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.515 178.552 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.909 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -55.74 -53.53 55.45 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.842 -179.662 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.59 ' CA ' ' HG ' ' A' ' 30' ' ' LEU . 2.2 p80 -53.93 -15.44 1.37 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -178.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.626 ' HA ' ' CE ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -92.85 -24.12 18.59 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.674 -179.815 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.552 ' HB2' HG21 ' A' ' 81' ' ' THR . 3.4 m-80 -130.8 28.71 4.82 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.832 0.349 . . . . 0.0 111.061 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.901 ' CB ' HD12 ' A' ' 71' ' ' LEU . 2.4 p-90 -88.99 -31.84 17.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.739 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.506 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 79.7 t60 -177.9 -52.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.652 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 168.04 120.19 0.51 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.568 -0.825 . . . . 0.0 113.105 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 61.97 128.51 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.838 179.499 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.439 ' HD2' ' CD2' ' A' ' 20' ' ' HIS . 7.6 tttt -64.11 -16.26 61.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.597 0.237 . . . . 0.0 110.917 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -44.94 -48.98 11.34 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.483 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -77.44 -39.45 46.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.482 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.809 ' O ' HD13 ' A' ' 30' ' ' LEU . 1.8 tm? -59.81 -28.2 67.25 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.425 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 1.4 t60 -46.39 -58.73 3.47 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.306 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.43 -21.88 60.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.746 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.863 ' CG1' HG13 ' A' ' 67' ' ' VAL . 2.2 t -83.41 -65.26 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.846 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.635 ' H ' HD13 ' A' ' 30' ' ' LEU . 1.3 t0 -61.37 -25.03 66.89 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.369 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.425 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 16.2 t-20 -58.77 -41.15 85.92 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 177.55 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.734 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -64.72 -46.95 80.09 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 177.171 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.97 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -51.44 -68.48 0.17 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.945 178.521 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.404 ' HG3' ' N ' ' A' ' 39' ' ' ASN . 9.0 pt20 -46.66 -41.77 15.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.133 -179.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.404 ' N ' ' HG3' ' A' ' 38' ' ' GLN . 1.5 t-20 -59.25 -26.54 64.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.24 179.419 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.772 HG12 ' CD1' ' A' ' 44' ' ' ILE . 14.9 t -70.92 -52.89 24.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.404 179.427 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 1.044 HD11 HD21 ' A' ' 12' ' ' LEU . 1.8 mp -46.07 -38.64 3.13 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.535 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.412 ' HA ' ' ND1' ' A' ' 45' ' ' HIS . 1.5 pt-20 -72.91 -28.74 62.65 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 120.747 0.308 . . . . 0.0 110.802 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.555 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 6.0 m-20 -84.14 -28.31 27.53 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.772 ' CD1' HG12 ' A' ' 40' ' ' VAL . 34.3 mt -86.56 -52.48 11.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.335 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.425 ' HB2' ' CB ' ' A' ' 6' ' ' ASN . 0.1 OUTLIER -63.27 -26.76 68.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.727 -179.943 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -86.68 -36.68 18.59 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.026 0.441 . . . . 0.0 110.01 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.555 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.2 m-85 -74.22 -42.1 60.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.28 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.518 ' HG3' ' HA2' ' A' ' 3' ' ' GLY . 12.1 ptp -51.73 -24.09 5.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.331 -179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -88.71 9.29 24.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.516 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 111.27 20.36 7.1 Favored Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.991 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.407 ' CA ' ' HA ' ' A' ' 47' ' ' PHE . . . -96.45 26.95 19.3 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.706 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.87 29.82 7.08 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.608 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.641 ' O ' HG11 ' A' ' 100' ' ' VAL . 0.2 OUTLIER -66.31 -12.92 59.37 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.514 0.19 . . . . 0.0 111.514 -179.9 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.455 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -83.16 71.63 2.98 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.668 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.414 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . 131.1 -9.45 5.68 Favored Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.803 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.497 ' HE3' ' CG ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -88.51 -34.38 17.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.668 0.27 . . . . 0.0 111.295 -179.749 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.594 HD21 HG23 ' A' ' 44' ' ' ILE . 0.1 OUTLIER -65.51 -11.58 44.77 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -179.197 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.414 ' HG2' ' O ' ' A' ' 55' ' ' GLY . 15.1 pt20 -86.47 -50.03 7.17 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.547 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 71.4 mt-10 -85.54 -31.02 22.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.835 0.35 . . . . 0.0 110.783 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.661 ' HG3' HG13 ' A' ' 40' ' ' VAL . 0.8 OUTLIER -78.11 -33.09 50.75 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.902 179.768 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.511 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 4.5 tmm? -55.37 -39.17 69.77 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.562 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.84 -17.27 62.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.967 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.95 -31.36 45.05 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.559 ' HA ' HD22 ' A' ' 37' ' ' LEU . 0.8 OUTLIER -87.27 -24.49 24.34 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.192 0.52 . . . . 0.0 109.597 179.351 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -83.02 -33.39 26.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.164 178.345 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -55.48 -38.44 69.12 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.904 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.97 HG21 ' HB2' ' A' ' 37' ' ' LEU . 3.9 t -51.57 -44.39 33.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.109 0.48 . . . . 0.0 110.285 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.884 HD21 HG13 ' A' ' 85' ' ' ILE . 0.9 OUTLIER -68.4 -6.71 26.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.003 179.302 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -75.85 -59.89 2.56 Favored 'General case' 0 C--N 1.338 0.092 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.468 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -48.44 -40.7 27.04 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 122.391 1.091 . . . . 0.0 108.564 177.447 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.909 HD13 ' CG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -70.74 -68.12 0.45 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 112.904 -1.953 . . . . 0.0 112.029 -179.421 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -51.15 -26.08 6.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.346 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -87.91 9.21 22.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.265 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.491 ' O ' ' N ' ' A' ' 76' ' ' GLN . 14.2 m-70 -158.68 35.63 0.22 Allowed 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.633 HD11 HG23 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -54.67 88.44 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.198 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 74' ' ' HIS . 3.6 tp60 -63.76 69.25 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.384 -178.226 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 57.11 30.68 61.0 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.401 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.428 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -130.62 39.12 1.84 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.587 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.462 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -49.47 -32.03 11.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.697 0.284 . . . . 0.0 111.26 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -63.18 -31.53 72.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.135 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.552 HG21 ' HB2' ' A' ' 22' ' ' ASN . 1.9 m -67.49 -72.57 0.16 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.908 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.808 ' CG1' HD21 ' A' ' 71' ' ' LEU . 42.9 t -51.48 -39.1 21.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.852 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.48 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.7 OUTLIER -46.6 -41.23 14.21 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 179.226 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -76.27 -29.73 57.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.729 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.884 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.38 -30.44 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.106 -179.675 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.3 OUTLIER -79.76 -46.51 16.86 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.929 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.428 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 1.7 mp0 -59.59 -27.51 66.34 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 177.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.529 ' O ' HD12 ' A' ' 92' ' ' ILE . 2.4 m120 -82.71 -69.17 0.65 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.811 178.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.949 ' CG1' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -49.84 -39.39 15.01 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.445 -179.964 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.504 ' O ' ' CD2' ' A' ' 93' ' ' PHE . 28.5 mmmt -63.54 -23.55 67.43 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 119.89 -0.724 . . . . 0.0 110.002 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -90.54 -8.75 49.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.177 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.835 HD13 ' HA ' ' A' ' 89' ' ' ILE . 1.2 mp -78.75 -56.31 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.977 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.504 ' CD2' ' O ' ' A' ' 90' ' ' LYS . 0.6 OUTLIER -45.72 -44.56 13.75 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.726 179.669 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.485 ' N ' ' CG ' ' A' ' 93' ' ' PHE . 9.3 t-160 -57.52 -61.43 2.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.789 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -61.54 -11.97 13.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.502 178.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 18.7 mt -89.18 -65.55 1.01 Allowed 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.972 0.415 . . . . 0.0 110.599 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -65.71 -13.31 59.03 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.114 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.478 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 4.4 tp10 -87.07 -26.94 23.44 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-O 120.938 0.399 . . . . 0.0 110.306 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.891 HD13 HD23 ' A' ' 5' ' ' LEU . 18.8 tp -66.19 -57.74 6.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.634 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.641 HG11 ' O ' ' A' ' 53' ' ' SER . 33.5 t -64.15 -37.66 80.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.21 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -60.91 -43.15 98.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.896 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.852 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mtt . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.838 0.351 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.443 ' HB3' HD21 ' A' ' 99' ' ' LEU . 5.5 m-85 -76.17 144.72 40.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.725 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.571 ' HA2' ' HG3' ' A' ' 48' ' ' MET . . . 177.1 -34.55 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.726 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.4 tptm -63.85 -17.43 63.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.481 0.181 . . . . 0.0 111.044 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.927 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -52.38 -22.9 5.12 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.198 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.459 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 26.3 p-10 -56.95 -46.38 82.16 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.02 179.266 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -49.43 -32.16 11.2 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.089 0.471 . . . . 0.0 110.209 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.608 ' C ' HD13 ' A' ' 8' ' ' LEU . 1.7 tm? -87.85 -26.65 22.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.384 179.246 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.826 HD22 HD12 ' A' ' 41' ' ' ILE . 1.0 OUTLIER -74.41 -40.94 61.68 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.748 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -49.3 -42.05 40.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.638 -179.725 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -50.41 -42.32 53.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.129 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.976 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -59.57 -62.53 1.81 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.678 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.731 ' H ' HD23 ' A' ' 12' ' ' LEU . 4.0 tt0 -51.17 -35.45 36.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.977 -179.339 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -77.39 -30.92 53.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.953 179.143 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.821 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -63.68 -32.48 57.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.831 179.033 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.811 ' CD1' HD13 ' A' ' 19' ' ' LEU . 3.6 mm? -59.45 -36.52 76.1 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.396 179.559 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.9 ttpt -43.02 -42.55 3.89 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.038 0.447 . . . . 0.0 110.291 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.68 ' HB3' HG23 ' A' ' 81' ' ' THR . 1.1 t30 -70.35 -44.96 67.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.7 178.673 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.916 HD12 HD22 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -48.03 -41.49 25.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.421 -179.969 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 1.048 ' CE1' HD12 ' A' ' 30' ' ' LEU . 50.0 m-70 -51.69 -35.01 41.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.927 -179.687 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.53 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.0 mmpt? -92.34 1.81 57.01 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -177.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.961 HD21 ' HA3' ' A' ' 78' ' ' GLY . 7.2 m120 -142.1 10.64 1.95 Allowed 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.385 -0.526 . . . . 0.0 112.323 -179.507 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.794 ' CA ' HD12 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -81.53 -36.88 28.64 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.809 179.734 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.503 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 86.3 t60 -179.99 -52.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.877 0.37 . . . . 0.0 110.672 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 154.71 149.72 5.34 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.536 -0.84 . . . . 0.0 113.046 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.13 103.66 0.01 OUTLIER Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.555 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -54.14 -23.01 12.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.756 0.313 . . . . 0.0 110.696 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.73 -32.97 21.15 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.858 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -85.27 -47.57 9.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.453 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.048 HD12 ' CE1' ' A' ' 20' ' ' HIS . 2.2 tm? -59.53 -29.69 68.07 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.418 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.4 OUTLIER -45.75 -56.45 5.29 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.685 179.738 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.92 -20.24 63.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.932 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.956 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.3 t -87.34 -62.75 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.762 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.602 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -60.99 -24.91 66.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.93 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 14.9 t-20 -58.64 -39.87 81.76 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 177.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.955 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.2 OUTLIER -61.68 -51.47 68.29 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.588 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.004 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -53.94 -68.12 0.21 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.965 178.651 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.772 ' O ' HG22 ' A' ' 41' ' ' ILE . 14.6 tm0? -46.81 -40.08 13.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.741 -179.239 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -69.01 -22.96 64.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.965 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.955 HG23 ' O ' ' A' ' 36' ' ' HIS . 66.5 t -78.33 -38.83 23.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.485 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.826 HD12 HD22 ' A' ' 9' ' ' LEU . 1.1 tp -48.1 -34.64 4.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.412 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -75.69 -37.33 59.62 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 120.967 0.413 . . . . 0.0 109.902 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.515 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -62.47 -30.59 71.36 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.637 178.768 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.552 HG23 HD13 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -86.85 -35.26 8.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.581 179.128 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.414 ' NE2' HG13 ' A' ' 41' ' ' ILE . 23.5 m170 -70.19 -42.12 72.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.738 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.25 -21.76 53.23 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.998 178.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.515 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.3 m-85 -88.64 -45.25 10.0 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.985 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.571 ' HG3' ' HA2' ' A' ' 3' ' ' GLY . 14.6 ptt? -49.79 -24.76 2.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.723 0.297 . . . . 0.0 111.488 -179.492 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 mm100 -90.61 15.29 11.23 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.534 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 102.54 26.13 7.39 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.867 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.41 ' CA ' ' HA ' ' A' ' 47' ' ' PHE . . . -104.07 31.51 8.58 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.649 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.35 23.94 7.76 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.769 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.522 ' O ' HG21 ' A' ' 100' ' ' VAL . 55.0 p -59.74 -20.2 55.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.673 0.273 . . . . 0.0 111.408 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.517 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -93.5 76.69 1.1 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.417 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.457 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . 135.53 -12.28 4.3 Favored Glycine 0 N--CA 1.453 -0.184 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.365 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.522 ' O ' ' HB3' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.4 -53.31 4.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.909 0.385 . . . . 0.0 110.593 179.589 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.552 HD13 HG23 ' A' ' 44' ' ' ILE . 0.5 OUTLIER -54.48 -11.52 0.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.224 -179.553 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -85.53 -51.89 6.2 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.162 179.845 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.98 -26.96 23.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.951 0.405 . . . . 0.0 110.251 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.532 ' CG ' HG13 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -77.67 -36.53 51.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.273 179.464 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.487 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 1.4 tmt? -50.4 -39.12 46.12 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.911 0.386 . . . . 0.0 110.705 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.89 -22.17 66.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.206 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.412 ' HB3' HG21 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -75.4 -42.4 53.85 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -179.396 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.614 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.0 OUTLIER -73.52 -24.53 60.16 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.121 0.486 . . . . 0.0 110.157 -179.989 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -82.77 -31.96 28.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.081 178.391 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -37.24 74.43 Favored 'General case' 0 C--O 1.231 0.079 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.674 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 1.004 HG21 ' HB2' ' A' ' 37' ' ' LEU . 84.9 t -54.29 -39.49 43.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.474 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 1.032 HD11 HD13 ' A' ' 89' ' ' ILE . 1.0 OUTLIER -75.84 -4.88 43.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.524 178.651 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -76.04 -56.81 4.31 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.572 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 7.9 tp10 -53.38 -38.04 62.99 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 122.098 0.951 . . . . 0.0 108.536 177.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.978 HD21 HG13 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -72.77 -67.17 0.58 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 113.485 -1.689 . . . . 0.0 111.939 -179.402 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.437 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 23.2 t-20 -50.68 -26.04 5.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.447 -179.485 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 21.9 m-20 -87.68 7.77 28.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.517 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.514 ' O ' ' N ' ' A' ' 76' ' ' GLN . 72.9 m-70 -154.09 31.92 0.44 Allowed 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.576 HD12 ' C ' ' A' ' 78' ' ' GLY . 0.2 OUTLIER -50.32 90.27 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.289 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -66.25 68.85 0.06 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.417 -177.997 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 58.44 24.78 56.81 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.75 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.961 ' HA3' HD21 ' A' ' 22' ' ' ASN . . . -130.96 46.23 1.09 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.236 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.46 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.2 OUTLIER -55.41 -32.5 62.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.693 0.283 . . . . 0.0 111.296 -179.697 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 37.4 p-80 -57.47 -33.43 67.97 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.052 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.68 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -67.15 -74.36 0.12 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.978 HG13 HD21 ' A' ' 71' ' ' LEU . 29.1 t -50.66 -42.06 21.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.2 179.432 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.467 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 42.4 t60 -48.83 -41.09 31.81 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.426 ' O ' ' HB3' ' A' ' 88' ' ' ASN . 84.7 t60 -76.47 -27.58 56.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.752 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 1.03 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.48 -33.1 7.48 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.149 -179.63 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.481 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -74.38 -45.71 45.1 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 179.102 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -59.14 -29.9 67.75 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 177.943 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.774 ' O ' HD13 ' A' ' 92' ' ' ILE . 0.1 OUTLIER -83.08 -58.63 2.77 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.494 179.344 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 1.032 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -60.57 -48.13 89.88 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.359 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.396 -179.313 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.425 ' N ' HG22 ' A' ' 89' ' ' ILE . 0.6 OUTLIER -61.5 -29.11 69.77 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 120.124 -0.631 . . . . 0.0 109.818 179.784 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -90.68 -2.41 57.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.196 178.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.774 HD13 ' O ' ' A' ' 88' ' ' ASN . 0.9 OUTLIER -77.82 -42.58 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.229 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.64 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -55.95 -27.95 54.76 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.13 178.842 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.64 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 16.9 t60 -62.39 -64.15 1.01 Allowed 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.25 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.434 ' HB3' HD11 ' A' ' 5' ' ' LEU . 4.7 m-70 -63.35 -9.86 13.99 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.127 178.499 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.758 HD21 ' HG ' ' A' ' 9' ' ' LEU . 32.7 mt -89.25 -63.37 1.3 Allowed 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.905 0.384 . . . . 0.0 110.317 179.664 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -63.36 -13.95 44.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.011 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -85.16 -28.7 25.32 Favored 'General case' 0 N--CA 1.458 -0.05 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.553 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.927 HD13 HD23 ' A' ' 5' ' ' LEU . 18.8 tp -62.66 -53.93 47.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.845 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.522 HG21 ' O ' ' A' ' 53' ' ' SER . 38.9 t -71.68 -27.84 29.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.36 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -94.83 33.57 1.46 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.142 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.911 179.851 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.796 0.331 . . . . 0.0 111.224 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -77.83 118.72 20.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.769 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 174.36 -31.45 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.805 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -59.13 -17.32 25.73 Favored 'General case' 0 CA--C 1.514 -0.412 0 O-C-N 122.825 -0.221 . . . . 0.0 111.136 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 1.048 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -50.46 -24.73 3.31 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.057 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.567 ' HA ' HD12 ' A' ' 9' ' ' LEU . 22.4 p-10 -57.95 -41.3 82.57 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.68 178.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -50.26 -30.99 12.99 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.179 0.514 . . . . 0.0 109.88 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.611 ' C ' HD13 ' A' ' 8' ' ' LEU . 2.4 tm? -84.96 -30.46 24.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.091 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.752 ' O ' HD23 ' A' ' 12' ' ' LEU . 15.5 mt -63.56 -34.36 77.64 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.563 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.77 -42.18 67.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.269 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.43 -46.81 69.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.945 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.902 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -58.31 -60.48 3.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.677 179.995 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.752 ' HA ' HD23 ' A' ' 16' ' ' LEU . 0.4 OUTLIER -52.59 -36.44 56.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.082 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -77.1 -29.91 55.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.249 -0.432 . . . . 0.0 109.901 179.206 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.878 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -64.09 -26.86 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.855 178.871 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' A' ' 13' ' ' GLN . 2.5 mm? -63.35 -35.91 81.96 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.694 178.685 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.432 ' HA ' ' CD2' ' A' ' 20' ' ' HIS . 3.0 ttpt -42.98 -35.06 1.11 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.244 0.545 . . . . 0.0 110.076 179.318 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.672 ' HB3' HG23 ' A' ' 81' ' ' THR . 0.8 OUTLIER -78.38 -49.92 12.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.064 178.818 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.809 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -47.37 -43.64 23.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.468 -179.885 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.783 ' N ' HD23 ' A' ' 19' ' ' LEU . 40.7 m-70 -49.49 -36.5 23.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.913 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.446 ' HE3' ' HB2' ' A' ' 20' ' ' HIS . 4.2 mmpt? -90.21 4.66 49.92 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.248 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.624 ' HB2' HG21 ' A' ' 81' ' ' THR . 9.8 m120 -148.61 18.59 1.03 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.998 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.927 ' CG ' HD23 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -88.05 -52.7 5.11 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.39 179.316 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.555 ' HB3' ' CZ2' ' A' ' 23' ' ' TRP . 10.6 t-160 179.94 52.1 0.0 OUTLIER 'General case' 0 C--O 1.232 0.153 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.223 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 70.63 120.62 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.255 0 N-CA-C 115.205 0.842 . . . . 0.0 115.205 177.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.78 130.02 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 115.207 -0.496 . . . . 0.0 114.321 177.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.416 ' HG3' ' CG ' ' A' ' 20' ' ' HIS . 3.5 ttpt -68.05 -14.85 63.29 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.398 -0.401 . . . . 0.0 110.023 178.311 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -46.79 -47.64 20.85 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.47 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -75.68 -46.98 28.21 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.801 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.927 HD23 ' CG ' ' A' ' 23' ' ' TRP . 0.3 OUTLIER -58.47 -28.02 64.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.004 0.43 . . . . 0.0 109.993 179.223 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.431 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 1.2 t60 -45.66 -48.76 14.87 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.451 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.09 -31.14 71.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.246 0.546 . . . . 0.0 110.142 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.931 ' CG1' HG13 ' A' ' 67' ' ' VAL . 2.4 t -72.32 -62.43 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.742 179.425 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.432 ' N ' HG12 ' A' ' 33' ' ' VAL . 0.8 OUTLIER -61.53 -21.57 64.37 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.307 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.431 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 0.6 OUTLIER -60.13 -41.18 92.14 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 177.312 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.633 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.3 OUTLIER -64.69 -49.74 69.76 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 177.205 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.034 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -51.92 -67.15 0.27 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.763 178.505 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.28 -42.88 10.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.812 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.9 m-20 -58.25 -30.32 66.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.031 179.314 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.767 HG12 HG13 ' A' ' 44' ' ' ILE . 21.7 t -65.19 -50.31 74.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.162 179.035 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.856 HD11 HD21 ' A' ' 12' ' ' LEU . 12.5 mm -44.24 -41.15 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.758 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.437 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 0.5 OUTLIER -72.65 -29.89 63.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.703 0.287 . . . . 0.0 111.018 -179.743 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.537 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.3 OUTLIER -84.32 -26.39 28.53 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 178.971 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.767 HG13 HG12 ' A' ' 40' ' ' VAL . 6.4 mm -87.3 -50.57 13.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.353 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.418 ' ND1' ' HA ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -67.21 -26.95 66.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.353 -179.597 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -86.48 -40.87 14.87 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 121.039 0.447 . . . . 0.0 110.054 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.537 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.4 m-85 -73.72 -25.41 60.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.442 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.738 ' SD ' HG22 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -50.62 -39.11 49.39 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.001 0.429 . . . . 0.0 110.83 179.466 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -67.04 -25.29 66.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.757 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 130.12 -3.41 5.95 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.894 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.91 -36.32 26.68 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.141 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.4 ' HA3' ' CD2' ' A' ' 47' ' ' PHE . . . -162.56 25.13 0.22 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 121.054 -0.594 . . . . 0.0 112.178 179.597 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.89 -175.87 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.899 0.38 . . . . 0.0 110.98 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 50.02 59.7 7.27 Favored Glycine 0 CA--C 1.517 0.217 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.66 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 147.9 -19.76 1.43 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.624 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.446 ' O ' ' CB ' ' A' ' 60' ' ' MET . 3.6 pptp? -88.18 -41.28 13.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.778 0.323 . . . . 0.0 111.023 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.672 HD11 ' HB3' ' A' ' 96' ' ' LEU . 14.1 tp -65.55 -9.72 28.86 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.884 -179.575 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -86.3 -49.41 7.7 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.826 179.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -87.31 -31.17 20.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.439 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.675 ' HG3' HG13 ' A' ' 40' ' ' VAL . 1.3 tpt -77.54 -30.82 52.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.845 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.52 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -56.24 -43.0 78.22 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.265 179.678 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.79 -20.18 63.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.02 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -74.29 -29.42 61.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.464 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.826 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.4 p90 -87.08 -28.97 22.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.962 0.411 . . . . 0.0 110.682 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.46 ' CG ' ' CE1' ' A' ' 64' ' ' PHE . 4.1 mt-30 -81.23 -34.14 32.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.92 179.525 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 9.0 tm0? -56.58 -35.13 67.85 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.855 0.36 . . . . 0.0 110.787 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 1.034 HG21 ' HB2' ' A' ' 37' ' ' LEU . 9.5 t -55.62 -49.11 76.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.327 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.986 HD11 HD13 ' A' ' 89' ' ' ILE . 1.2 mp -65.1 -10.85 33.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.738 179.178 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -69.54 -59.86 2.7 Favored 'General case' 0 N--CA 1.458 -0.068 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.34 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.483 ' CG ' ' CZ3' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -48.91 -40.91 31.83 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 122.232 1.015 . . . . 0.0 109.198 177.769 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.918 HD21 HG13 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -69.99 -67.78 0.46 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 113.313 -1.767 . . . . 0.0 112.207 -179.279 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.503 ' ND2' HG11 ' A' ' 82' ' ' VAL . 14.2 m120 -49.24 -30.0 6.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.033 -179.185 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -87.4 9.4 20.79 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.628 0.232 . . . . 0.0 111.628 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.507 ' O ' ' N ' ' A' ' 76' ' ' GLN . 85.4 m-70 -151.98 27.89 0.61 Allowed 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.636 HD11 HG23 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -51.38 89.34 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 178.32 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.507 ' N ' ' O ' ' A' ' 74' ' ' HIS . 3.9 mm-40 -66.36 68.09 0.06 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.19 -178.352 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.421 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 56.36 46.56 86.72 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.66 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.437 ' HA3' ' ND2' ' A' ' 22' ' ' ASN . . . -152.21 39.39 0.76 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.502 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.48 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -46.89 -39.73 12.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.716 0.293 . . . . 0.0 111.332 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 31.7 t60 -47.99 -33.57 8.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.55 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.672 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.3 m -67.97 -73.53 0.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.262 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.918 HG13 HD21 ' A' ' 71' ' ' LEU . 25.3 t -50.15 -40.31 17.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.037 179.626 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.475 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 10.3 t60 -48.91 -41.14 32.61 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -76.61 -28.87 56.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.801 178.593 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.96 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.28 -31.16 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.137 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.012 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -76.01 -48.41 21.13 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.568 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.77 -30.06 60.64 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 177.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.691 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.9 m-80 -83.08 -59.52 2.45 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.676 179.152 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.986 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -60.96 -50.32 81.05 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.882 -179.323 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.512 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 1.3 mptp? -61.43 -29.09 69.72 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.878 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -90.69 0.13 57.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.982 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.691 HD13 ' O ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER -78.67 -45.01 25.66 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.031 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.637 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -53.05 -26.35 15.59 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.081 178.419 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.637 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.7 OUTLIER -60.29 -64.22 1.03 Allowed 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.296 -179.365 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.843 ' HB3' HD11 ' A' ' 5' ' ' LEU . 21.8 m-70 -66.02 -9.52 31.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.351 178.668 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.672 ' HB3' HD11 ' A' ' 57' ' ' LEU . 34.9 mt -89.17 -58.16 2.64 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 120.944 0.402 . . . . 0.0 110.442 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.461 ' N ' HD21 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -70.68 -10.93 60.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.061 178.78 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -90.7 -12.99 35.01 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.969 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 1.048 HD13 HD23 ' A' ' 5' ' ' LEU . 4.5 tp -87.11 -56.58 3.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.002 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 45.9 t -62.98 -46.03 97.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.273 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -60.04 -30.03 68.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.011 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.145 -0.931 . . . . 0.0 110.857 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mtt . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 120.787 0.327 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.585 ' HB3' HD11 ' A' ' 99' ' ' LEU . 2.6 m-85 -96.52 90.59 5.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.837 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -131.73 3.82 5.38 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.734 -0.746 . . . . 0.0 113.068 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -82.31 -21.63 36.0 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 116.856 0.328 . . . . 0.0 110.971 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.79 HD23 HD13 ' A' ' 99' ' ' LEU . 0.2 OUTLIER -51.26 -21.98 2.46 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.371 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.458 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 8.5 t30 -62.46 -40.41 96.54 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.789 178.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -50.44 -30.12 11.83 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.226 0.536 . . . . 0.0 109.745 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.753 ' O ' HD13 ' A' ' 8' ' ' LEU . 2.9 tm? -85.67 -27.71 25.19 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.953 178.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.73 ' O ' HD23 ' A' ' 12' ' ' LEU . 13.4 mt -70.83 -13.06 61.9 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.092 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -75.4 -42.21 54.27 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.805 0.336 . . . . 0.0 111.322 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -56.53 -48.17 77.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.186 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.922 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -54.78 -58.84 5.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.632 -179.874 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.723 ' HA ' HD23 ' A' ' 16' ' ' LEU . 1.4 tt0 -52.38 -35.54 51.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.955 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.87 -28.18 49.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.973 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.87 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -67.64 -26.8 36.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.196 179.286 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.723 HD23 ' HA ' ' A' ' 13' ' ' GLN . 2.4 mm? -62.85 -36.15 82.28 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.247 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.432 ' HA ' ' CE ' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -46.66 -40.27 12.85 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.047 0.451 . . . . 0.0 109.933 179.397 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.579 ' HB3' HG23 ' A' ' 81' ' ' THR . 0.6 OUTLIER -68.21 -41.01 81.94 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.241 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.935 HD12 HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -57.22 -38.37 73.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.737 179.534 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.953 ' CE1' HD12 ' A' ' 30' ' ' LEU . 39.8 m-70 -51.68 -34.84 40.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.853 0.359 . . . . 0.0 111.144 179.689 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.533 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.7 mmpt? -94.15 2.36 55.97 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -178.516 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.675 ' HB2' HG21 ' A' ' 81' ' ' THR . 0.7 OUTLIER -139.54 5.75 2.24 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -179.548 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.987 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -80.47 -37.11 32.47 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.109 179.41 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.494 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 86.0 t60 -176.75 -49.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.736 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 146.86 132.38 2.31 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.102 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 80.48 101.25 0.31 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.522 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.84 -25.45 7.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.753 0.311 . . . . 0.0 110.451 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.81 -31.48 49.28 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.432 179.475 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -85.25 -42.88 14.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.343 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.987 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.2 tm? -62.76 -34.72 77.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.923 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.474 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 33.7 t-80 -47.74 -39.49 17.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.214 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -76.59 -21.89 54.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.676 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.823 ' O ' HG22 ' A' ' 67' ' ' VAL . 1.6 p -91.66 -46.73 14.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.716 -0.22 . . . . 0.0 111.254 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.581 ' HB2' HD11 ' A' ' 30' ' ' LEU . 2.7 t70 -72.97 -27.16 61.65 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.264 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 11.4 t-20 -53.94 -32.68 54.48 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 178.46 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.863 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -63.73 -34.36 77.69 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.287 178.384 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.676 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -71.3 -66.3 0.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.195 179.202 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -47.37 -35.69 8.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.015 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -70.16 -31.71 69.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.229 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.87 HG12 HD11 ' A' ' 44' ' ' ILE . 49.5 t -71.49 -36.9 62.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.213 179.257 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.669 HD11 HD21 ' A' ' 12' ' ' LEU . 35.2 mm -49.79 -35.42 10.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.851 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -25.39 56.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.202 179.326 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.564 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 3.3 m-20 -82.19 -27.24 32.73 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.621 178.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.87 HD11 HG12 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -87.08 -52.71 11.33 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.121 179.321 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.13 -27.31 68.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.707 0.289 . . . . 0.0 110.701 -179.733 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -86.83 -32.55 20.23 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.087 0.47 . . . . 0.0 110.161 179.446 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.564 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.3 m-85 -81.6 -45.87 15.21 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.703 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.425 ' HB3' ' HE2' ' A' ' 48' ' ' MET . 11.5 ptp -50.23 -24.4 2.84 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.446 -179.501 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -89.92 13.14 15.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.628 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 104.73 25.94 6.65 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.787 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -102.14 27.01 22.28 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.561 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 101.78 27.34 7.13 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.543 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.522 ' O ' HG11 ' A' ' 100' ' ' VAL . 0.1 OUTLIER -64.89 -15.73 62.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.659 0.266 . . . . 0.0 111.35 -179.917 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.46 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -85.82 73.26 2.59 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.61 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 131.92 -12.43 5.33 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.635 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.534 ' HZ3' ' HB3' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.39 -28.14 21.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.612 0.244 . . . . 0.0 110.956 -179.881 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.517 ' O ' ' HB2' ' A' ' 61' ' ' MET . 0.4 OUTLIER -70.16 -9.2 54.92 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 121.021 -0.272 . . . . 0.0 111.722 -179.679 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.402 ' CG ' ' N ' ' A' ' 59' ' ' GLU . 15.1 pt20 -86.77 -50.81 6.48 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.615 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.402 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 0.4 OUTLIER -86.22 -31.74 21.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.802 -179.726 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.534 ' HB3' ' HZ3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -78.39 -30.8 48.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.098 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.517 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -59.37 -41.75 90.05 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.316 179.708 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -60.78 -19.47 59.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.576 179.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.622 ' HB3' HG21 ' A' ' 40' ' ' VAL . 15.8 tt0 -74.26 -31.35 62.52 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.508 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.558 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.0 OUTLIER -87.41 -26.37 23.33 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.01 0.433 . . . . 0.0 109.891 179.608 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -82.51 -32.2 28.83 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.877 178.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -59.03 -33.62 70.95 Favored 'General case' 0 C--O 1.23 0.063 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.488 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.823 HG22 ' O ' ' A' ' 33' ' ' VAL . 87.9 t -54.96 -38.35 45.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.178 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 1.039 HD21 HG13 ' A' ' 85' ' ' ILE . 1.8 mp -74.98 -7.55 53.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.513 178.84 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -74.31 -59.45 2.72 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.501 ' HB3' HG21 ' A' ' 33' ' ' VAL . 6.8 tp10 -51.67 -34.48 38.48 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 122.029 0.919 . . . . 0.0 108.786 177.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.935 HD13 HD12 ' A' ' 19' ' ' LEU . 0.3 OUTLIER -72.53 -65.78 0.74 Allowed 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 113.613 -1.631 . . . . 0.0 111.806 -179.418 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.482 ' HA ' HD22 ' A' ' 75' ' ' LEU . 15.1 t-20 -51.18 -24.27 4.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.851 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -85.14 2.78 42.08 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -179.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.578 ' O ' ' N ' ' A' ' 76' ' ' GLN . 2.4 m-70 -151.53 36.34 0.57 Allowed 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.677 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.663 HD11 HG23 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -52.08 86.55 0.0 OUTLIER 'General case' 0 C--O 1.231 0.119 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.733 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.578 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -79.16 -39.17 34.14 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.485 -177.399 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -101.1 25.15 29.36 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 120.505 -0.855 . . . . 0.0 114.077 -178.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 88.8 127.32 2.9 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.855 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.561 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -50.46 -19.97 1.01 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.606 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -40.86 -38.16 0.9 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.749 0.309 . . . . 0.0 111.615 -179.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.675 HG21 ' HB2' ' A' ' 22' ' ' ASN . 1.3 m -69.48 -73.34 0.16 Allowed 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 178.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.791 ' CG1' HD21 ' A' ' 71' ' ' LEU . 41.8 t -47.39 -37.02 4.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.975 179.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.505 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -50.52 -41.46 53.75 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.1 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -76.43 -27.9 56.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.537 178.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 1.039 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -84.07 -33.98 9.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.731 179.972 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.587 ' O ' ' HB2' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -74.31 -51.7 14.43 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 178.939 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 3.9 mm100 -54.16 -28.19 38.61 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.245 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -83.01 -67.12 0.81 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.08 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.969 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -50.46 -33.45 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.528 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.587 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 0.9 OUTLIER -67.75 -24.82 65.39 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.717 -0.793 . . . . 0.0 109.609 179.798 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -86.88 -4.95 59.23 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.075 178.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.834 HD13 ' HA ' ' A' ' 89' ' ' ILE . 1.7 mp -78.47 -57.86 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 179.45 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.489 ' CD1' ' C ' ' A' ' 93' ' ' PHE . 0.2 OUTLIER -46.12 -44.79 16.0 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.561 178.958 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.48 ' N ' ' CG ' ' A' ' 93' ' ' PHE . 1.1 t60 -57.92 -61.4 2.56 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.958 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.594 ' HB3' HD11 ' A' ' 5' ' ' LEU . 1.4 m-70 -61.44 -12.19 13.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.526 178.633 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.675 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 20.3 mt -89.25 -65.47 1.01 Allowed 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.927 0.394 . . . . 0.0 110.494 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -64.12 -14.07 52.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.201 179.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.432 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 3.5 tp10 -86.7 -24.98 25.01 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.559 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.79 HD13 HD23 ' A' ' 5' ' ' LEU . 7.5 tp -70.46 -57.14 5.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.626 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.522 HG11 ' O ' ' A' ' 53' ' ' SER . 42.3 t -60.09 -28.47 41.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.18 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -96.08 32.99 1.8 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.136 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.862 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.6 mtt . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.776 0.322 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.518 ' HB3' ' HB3' ' A' ' 99' ' ' LEU . 9.3 m-85 -103.81 66.76 0.86 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.865 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -123.2 -21.63 2.5 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.708 -0.758 . . . . 0.0 113.007 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.412 ' HA ' ' CE ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -60.44 -18.83 53.63 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 116.807 0.303 . . . . 0.0 111.38 -179.727 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.76 HD13 ' HB3' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -52.84 -20.99 3.69 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.352 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.497 ' HA ' HD12 ' A' ' 9' ' ' LEU . 24.4 p-10 -54.3 -44.71 72.21 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.362 178.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -53.83 -29.43 40.92 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.76 ' HB3' HD13 ' A' ' 5' ' ' LEU . 1.5 tm? -87.41 -28.61 22.04 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.782 178.649 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.83 ' O ' HD23 ' A' ' 12' ' ' LEU . 10.7 mt -60.11 -35.67 75.76 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 121.179 0.514 . . . . 0.0 109.85 179.372 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -55.37 -37.7 67.87 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.153 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.2 -53.01 39.07 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.965 0.412 . . . . 0.0 110.725 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.898 ' O ' HG12 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -54.78 -57.1 12.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.322 179.55 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.671 ' HA ' HD23 ' A' ' 16' ' ' LEU . 31.0 tt0 -52.18 -36.48 51.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.795 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.57 -30.66 57.13 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.898 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -62.81 -26.23 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.828 178.753 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.692 HD12 HD13 ' A' ' 19' ' ' LEU . 3.2 mm? -65.52 -32.77 74.55 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.539 178.737 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.18 -37.11 2.96 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.232 0.539 . . . . 0.0 110.146 179.131 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.661 ' HB3' HG23 ' A' ' 81' ' ' THR . 11.1 m120 -77.4 -49.21 15.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.986 178.801 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.848 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -43.22 -49.33 6.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.818 -179.88 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.836 ' CD2' HD12 ' A' ' 30' ' ' LEU . 41.0 m80 -48.21 -40.54 24.66 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -179.244 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.487 ' HE3' ' HB2' ' A' ' 20' ' ' HIS . 2.8 mmpt? -87.25 7.61 27.73 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -177.699 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.583 ' HB2' HG21 ' A' ' 81' ' ' THR . 30.8 m120 -153.93 19.25 0.51 Allowed 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.315 -0.554 . . . . 0.0 112.195 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.78 ' CB ' HD12 ' A' ' 71' ' ' LEU . 0.5 OUTLIER -87.05 -33.7 19.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.986 0.422 . . . . 0.0 110.08 178.972 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.51 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 3.7 t60 -177.15 -51.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.579 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 160.26 130.26 1.11 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.464 -0.874 . . . . 0.0 113.12 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.68 120.39 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.74 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HD2' ' CG ' ' A' ' 20' ' ' HIS . 18.8 tttt -62.22 -18.64 61.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.651 0.262 . . . . 0.0 110.771 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -50.25 -41.01 49.51 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.98 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -77.86 -49.49 14.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.491 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.836 HD12 ' CD2' ' A' ' 20' ' ' HIS . 1.4 tm? -56.42 -30.23 62.55 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.237 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.3 OUTLIER -45.79 -43.96 13.63 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.995 179.993 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.64 -26.23 64.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.081 0.467 . . . . 0.0 110.54 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.887 ' CG1' HG13 ' A' ' 67' ' ' VAL . 2.3 t -83.5 -62.29 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.888 179.744 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.701 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -58.5 -23.05 57.03 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.333 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 1.7 m-20 -59.73 -41.08 90.11 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 177.77 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.797 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.8 OUTLIER -62.69 -49.48 74.94 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 177.485 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.002 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -56.15 -68.71 0.18 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.571 178.358 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -47.13 -43.86 21.07 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.27 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -61.24 -27.99 68.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.551 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 36' ' ' HIS . 68.0 t -76.0 -41.48 38.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.557 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.793 HD11 HD21 ' A' ' 12' ' ' LEU . 25.9 mm -47.91 -36.8 5.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.164 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 0.1 OUTLIER -71.8 -29.1 64.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.433 179.646 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.555 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 13.7 m-20 -84.19 -27.27 28.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.931 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.732 HG13 HG12 ' A' ' 40' ' ' VAL . 1.8 mt -86.85 -52.77 11.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.188 179.398 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -28.12 69.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.237 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -86.77 -38.68 16.66 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 120.961 0.41 . . . . 0.0 110.316 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.555 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.2 m-85 -77.68 -24.01 49.41 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.711 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.481 ' CE ' HD13 ' A' ' 99' ' ' LEU . 0.8 OUTLIER -52.41 -36.98 55.56 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 121.093 0.473 . . . . 0.0 110.502 179.482 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -71.67 -11.22 60.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.124 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 118.62 20.78 4.13 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.752 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -86.37 27.56 5.64 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.44 -0.886 . . . . 0.0 111.954 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.405 ' O ' ' HG2' ' A' ' 56' ' ' LYS . . . 115.7 27.39 3.05 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.121 -0.561 . . . . 0.0 112.12 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.514 ' O ' HG22 ' A' ' 100' ' ' VAL . 16.4 t -85.76 36.51 0.66 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.753 0.311 . . . . 0.0 111.611 -179.581 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -107.1 -32.89 3.36 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.586 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.427 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . -135.62 7.95 4.26 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.986 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.562 ' HE3' ' HA ' ' A' ' 44' ' ' ILE . 0.0 OUTLIER -88.6 -41.14 12.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.983 0.42 . . . . 0.0 111.375 179.959 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.497 ' O ' ' CB ' ' A' ' 61' ' ' MET . 49.8 tp -60.26 -11.68 7.01 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.817 -0.628 . . . . 0.0 112.289 -178.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 1.7 pp0? -86.24 -50.31 7.06 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.657 -0.417 . . . . 0.0 111.202 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.97 -32.23 20.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.827 0.346 . . . . 0.0 110.454 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.529 ' CG ' HG13 ' A' ' 40' ' ' VAL . 29.9 tpp -75.73 -29.78 59.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.473 179.564 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.497 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 3.0 ttt -52.58 -40.74 62.93 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.905 0.383 . . . . 0.0 110.312 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.6 tptt -63.07 -24.21 67.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.857 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.656 ' HB3' HG21 ' A' ' 40' ' ' VAL . 13.2 tt0 -70.28 -30.88 68.02 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.385 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.8 ' HA ' HD22 ' A' ' 37' ' ' LEU . 0.8 OUTLIER -86.96 -30.04 21.59 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.085 0.469 . . . . 0.0 110.228 179.866 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -82.4 -31.62 29.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.568 179.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -59.36 -37.16 77.18 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.786 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 1.002 HG21 ' HB2' ' A' ' 37' ' ' LEU . 3.9 t -53.39 -42.75 49.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.434 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 1.016 HD21 HG13 ' A' ' 85' ' ' ILE . 0.8 OUTLIER -70.76 -7.09 42.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.858 179.306 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -73.37 -55.96 5.69 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.648 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 2.6 tp10 -53.69 -38.01 63.8 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 122.018 0.913 . . . . 0.0 108.885 177.748 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.995 HD21 HG13 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -75.05 -70.82 0.39 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 113.686 -1.597 . . . . 0.0 112.283 -178.928 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.41 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 8.0 p-10 -49.32 -27.38 3.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.608 -179.178 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.409 ' N ' ' OD1' ' A' ' 72' ' ' ASN . 0.7 OUTLIER -91.69 13.65 17.48 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.271 179.998 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.467 ' O ' ' N ' ' A' ' 76' ' ' GLN . 25.2 m80 -151.96 24.31 0.66 Allowed 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.581 ' CD2' HG21 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -47.63 94.74 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.887 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.467 ' N ' ' O ' ' A' ' 74' ' ' HIS . 9.9 tp60 -59.39 -61.61 2.5 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.34 -177.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.4 31.78 0.44 Allowed Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.235 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.556 ' HA3' ' ND2' ' A' ' 22' ' ' ASN . . . -141.15 49.36 0.78 Allowed Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.804 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.454 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -48.63 -27.52 2.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.716 0.293 . . . . 0.0 110.882 179.623 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -67.5 -26.92 66.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.954 179.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.661 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -68.04 -75.1 0.11 Allowed 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 179.274 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.995 HG13 HD21 ' A' ' 71' ' ' LEU . 21.3 t -48.3 -42.95 11.84 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.765 179.356 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.495 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 1.8 t60 -47.93 -42.05 26.29 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.226 0.536 . . . . 0.0 109.797 179.235 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.3 m80 -76.44 -28.42 56.58 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.675 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 1.016 HG13 HD21 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -85.48 -29.99 6.46 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.178 -179.616 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -76.75 -46.82 23.78 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 178.869 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -60.67 -27.91 68.2 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.719 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.7 m-80 -83.05 -58.31 2.91 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.263 178.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.988 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -62.17 -47.99 90.55 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.287 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.32 -179.739 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.45 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -61.69 -28.37 69.35 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.042 -0.663 . . . . 0.0 109.724 179.735 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -90.56 -1.26 57.88 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.09 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.719 HD13 ' O ' ' A' ' 88' ' ' ASN . 0.9 OUTLIER -78.64 -44.09 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.287 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.638 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -55.06 -27.0 41.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.137 178.585 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.638 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 2.6 t-160 -62.75 -59.8 4.38 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.853 -179.599 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.45 ' O ' ' HG2' ' A' ' 98' ' ' GLU . 38.9 m170 -67.3 -11.03 56.53 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.189 178.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.583 ' HA ' HD12 ' A' ' 99' ' ' LEU . 36.6 mt -90.0 -56.97 3.02 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.004 0.431 . . . . 0.0 110.818 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -65.23 -10.63 33.46 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.472 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 95' ' ' HIS . 14.2 pt-20 -81.97 -28.07 32.87 Favored 'General case' 0 N--CA 1.461 0.091 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.508 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.716 HD21 HD23 ' A' ' 5' ' ' LEU . 1.7 mt -69.43 -64.05 0.95 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.183 0.516 . . . . 0.0 110.639 179.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 53' ' ' SER . 21.7 t -59.77 -26.58 35.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.012 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -85.39 -35.15 21.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.775 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.406 ' O ' ' CZ ' ' A' ' 2' ' ' TYR . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.141 -0.933 . . . . 0.0 110.873 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.899 0.38 . . . . 0.0 111.185 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' TYR . . . . . 0.402 ' N ' ' CD1' ' A' ' 2' ' ' TYR . 2.3 m-85 -101.09 76.88 1.77 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.841 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -130.11 3.59 5.96 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.892 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.8 tpmt? -84.12 -17.73 39.14 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 116.765 0.282 . . . . 0.0 110.649 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.93 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -53.79 -20.63 5.96 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 177.985 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.435 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 35.5 p-10 -61.2 -42.6 98.87 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.677 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -49.43 -29.47 6.54 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.17 0.509 . . . . 0.0 109.802 179.093 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.537 ' O ' HD13 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -84.39 -34.46 23.57 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.067 179.038 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.715 ' O ' HD23 ' A' ' 12' ' ' LEU . 7.8 mt -64.07 -29.56 70.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.082 0.468 . . . . 0.0 110.598 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.63 -49.94 64.14 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.337 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -54.52 -46.07 73.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.881 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.991 ' O ' HG12 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -54.53 -61.0 2.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.491 179.747 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.809 ' HA ' HD23 ' A' ' 16' ' ' LEU . 4.9 tt0 -52.76 -37.42 59.42 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.617 -179.089 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.41 -30.26 53.47 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.035 0.445 . . . . 0.0 110.052 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.991 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.9 OUTLIER -64.96 -27.48 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.104 178.984 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.969 HD13 HD11 ' A' ' 85' ' ' ILE . 2.6 mm? -61.63 -39.69 92.19 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 178.291 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.3 ttpt -39.14 -39.55 0.6 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.005 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.812 ' HB3' HG23 ' A' ' 81' ' ' THR . 7.4 m-20 -66.01 -55.68 15.47 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.419 -0.809 . . . . 0.0 108.982 178.018 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.905 HD21 HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -39.47 -47.57 1.86 Allowed 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 114.561 -1.2 . . . . 0.0 111.969 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.798 ' NE2' HD12 ' A' ' 30' ' ' LEU . 67.6 m80 -50.64 -37.03 38.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.58 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.6 mmpt? -94.23 8.37 42.0 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -177.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.589 ' HB2' HG21 ' A' ' 81' ' ' THR . 35.0 m120 -152.69 10.14 0.48 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.143 -0.623 . . . . 0.0 112.57 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 1.041 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -75.16 -34.71 61.62 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.846 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.51 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 81.7 t60 -178.41 -50.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.672 178.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -130.88 -91.68 0.57 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.027 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -136.11 -142.52 4.51 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.888 -0.672 . . . . 0.0 111.785 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.426 ' HA ' ' HB3' ' A' ' 30' ' ' LEU . 9.8 tttm -93.62 -18.53 22.08 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.612 0.244 . . . . 0.0 111.125 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -54.66 -56.31 20.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.804 0.335 . . . . 0.0 110.928 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -79.96 -17.41 53.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.021 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.041 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.2 tm? -80.9 -31.74 35.06 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.038 0.447 . . . . 0.0 109.936 179.455 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.426 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.4 OUTLIER -51.47 -36.91 46.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.116 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -76.57 -25.22 53.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.505 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.778 ' CG1' HD22 ' A' ' 30' ' ' LEU . 1.5 p -90.35 -42.71 14.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.062 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.498 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 1.2 t0 -73.13 -31.77 64.5 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 179.11 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 13.1 t-20 -51.97 -29.55 21.08 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.798 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.9 OUTLIER -72.69 -36.41 67.87 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.344 -0.844 . . . . 0.0 109.408 178.574 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.771 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -68.45 -66.81 0.52 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.38 179.267 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -45.39 -36.0 3.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.307 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -65.99 -31.07 71.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.943 0.402 . . . . 0.0 110.39 179.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.847 HG12 ' CG1' ' A' ' 44' ' ' ILE . 32.6 t -64.55 -53.86 37.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.8 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.816 HD11 HD21 ' A' ' 12' ' ' LEU . 38.3 mm -38.1 -42.35 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.935 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -71.7 -39.68 70.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.793 0.33 . . . . 0.0 110.405 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.473 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.7 OUTLIER -71.72 -28.64 63.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.549 179.399 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.847 ' CG1' HG12 ' A' ' 40' ' ' VAL . 7.1 mm -86.83 -40.53 14.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.867 0.365 . . . . 0.0 110.686 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.687 ' NE2' HG23 ' A' ' 41' ' ' ILE . 13.7 m170 -73.87 -39.01 64.26 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.345 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -74.38 -26.09 59.89 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.473 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.6 m-85 -88.61 -46.19 9.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.979 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.44 ' HE1' ' N ' ' A' ' 5' ' ' LEU . 8.4 ptm -46.49 -32.38 3.29 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.84 0.352 . . . . 0.0 111.406 -179.522 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -26.57 66.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.244 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 146.52 -13.75 1.59 Allowed Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.599 -0.81 . . . . 0.0 113.009 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.73 -42.65 37.13 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.86 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 168.69 39.2 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.607 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.432 ' HB3' ' HA ' ' A' ' 48' ' ' MET . 7.8 p -59.35 -24.38 63.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.735 0.302 . . . . 0.0 111.032 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.7 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -88.95 57.93 4.02 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.298 179.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 171.14 -28.1 0.11 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.937 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.609 ' HE3' HD13 ' A' ' 44' ' ' ILE . 0.6 OUTLIER -87.94 -30.04 20.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.921 0.361 . . . . 0.0 110.974 -179.866 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.601 HD13 ' HZ1' ' A' ' 56' ' ' LYS . 12.8 tp -61.53 -10.92 8.97 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.046 -0.261 . . . . 0.0 111.602 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.421 ' CG ' ' N ' ' A' ' 59' ' ' GLU . 13.4 pt20 -85.75 -49.86 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.751 -0.38 . . . . 0.0 110.798 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.421 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 19.7 mm-40 -87.42 -33.8 18.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.133 0.492 . . . . 0.0 110.295 179.342 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.728 ' HG3' HG13 ' A' ' 40' ' ' VAL . 3.5 tpt -74.6 -27.19 60.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.834 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.503 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 3.9 ttp -58.48 -47.61 83.49 Favored 'General case' 0 C--O 1.231 0.086 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.013 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -62.28 -24.51 67.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.512 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.426 ' HG2' HG22 ' A' ' 40' ' ' VAL . 1.1 tp10 -67.8 -32.29 72.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.318 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.555 ' HA ' HD22 ' A' ' 37' ' ' LEU . 0.9 OUTLIER -86.99 -33.47 19.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.888 0.375 . . . . 0.0 110.511 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.404 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 10.2 tt0 -80.76 -32.8 35.41 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.997 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.66 -33.09 71.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.768 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.771 HG22 ' O ' ' A' ' 33' ' ' VAL . 95.1 t -58.46 -44.32 88.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.57 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 1.062 HD11 HD13 ' A' ' 89' ' ' ILE . 1.3 mp -73.21 -6.37 45.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.78 179.18 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -73.1 -54.37 8.68 Favored 'General case' 0 N--CA 1.457 -0.122 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.508 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 5.3 tp10 -57.95 -31.72 67.12 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.881 0.848 . . . . 0.0 108.967 177.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 1.01 ' CD2' HG13 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -76.98 -72.04 0.37 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.905 -1.498 . . . . 0.0 112.378 -178.8 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.53 ' HA ' HG11 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -51.45 -26.13 7.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.46 -179.171 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -86.45 8.15 22.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.166 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.527 ' O ' ' N ' ' A' ' 76' ' ' GLN . 36.5 m-70 -146.41 29.46 1.05 Allowed 'General case' 0 CA--C 1.523 -0.094 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.586 HD11 HG23 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -49.93 88.9 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.236 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 74' ' ' HIS . 1.4 tm0? -62.37 -48.75 78.38 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.94 0.4 . . . . 0.0 110.76 -178.696 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -172.54 34.91 0.13 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.334 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.442 ' HA3' ' ND2' ' A' ' 22' ' ' ASN . . . -142.55 49.77 0.73 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.659 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.442 ' N ' ' HD2' ' A' ' 79' ' ' LYS . 0.0 OUTLIER -45.5 -36.26 4.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.618 0.246 . . . . 0.0 111.246 179.952 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 36.0 m80 -59.72 -40.78 89.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.605 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.9 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.4 m -59.28 -64.47 0.93 Allowed 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.939 179.118 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 1.01 HG13 ' CD2' ' A' ' 71' ' ' LEU . 9.5 t -60.05 -49.29 84.6 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.093 -179.721 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.521 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 1.4 m-70 -50.77 -40.23 54.48 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.946 -0.301 . . . . 0.0 110.773 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -75.41 -56.4 4.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.909 0.385 . . . . 0.0 110.28 179.458 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.969 HD11 HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -58.33 -32.98 46.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.751 179.477 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.619 ' HA ' HD22 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -81.16 -39.87 24.85 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.638 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.521 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 1.1 mp0 -66.79 -25.94 66.71 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 177.12 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.791 ' O ' HD13 ' A' ' 92' ' ' ILE . 2.4 m120 -82.65 -52.96 6.31 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.746 178.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 1.062 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -66.18 -50.49 68.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.932 179.843 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.502 ' N ' HG22 ' A' ' 89' ' ' ILE . 0.3 OUTLIER -56.96 -27.31 61.07 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 120.43 -0.508 . . . . 0.0 109.991 -179.855 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -90.7 -5.34 55.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.354 178.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.791 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.0 OUTLIER -78.6 -46.2 24.97 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 179.38 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.622 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.2 OUTLIER -48.53 -28.92 3.69 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.348 178.976 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.622 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.5 OUTLIER -60.12 -62.99 1.46 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.102 -179.518 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.494 ' HB3' HD11 ' A' ' 5' ' ' LEU . 1.7 m-70 -68.07 -8.72 40.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.345 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.482 ' HB2' ' HA ' ' A' ' 93' ' ' PHE . 23.0 mt -88.52 -56.17 3.42 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.995 0.426 . . . . 0.0 110.009 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.412 ' HG2' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -71.63 -9.81 58.81 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.824 178.486 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -88.16 -30.5 19.74 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.514 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.93 HD13 HD23 ' A' ' 5' ' ' LEU . 10.8 tp -67.6 -56.07 10.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.918 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.7 HG11 ' HA2' ' A' ' 54' ' ' GLY . 21.2 t -62.2 -37.99 79.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.417 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -63.73 -39.22 93.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.938 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.874 179.94 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.449 ' HA2' ' HB3' ' A' ' 48' ' ' MET . . . . . . . . 0 N--CA 1.45 -0.421 0 N-CA-C 112.788 -0.125 . . . . 0.0 112.788 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.0 tptt -62.97 -17.42 62.04 Favored 'General case' 0 CA--C 1.513 -0.455 0 O-C-N 122.809 -0.23 . . . . 0.0 111.327 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 1.089 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -52.88 -23.43 7.07 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.005 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.415 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 39.4 p-10 -61.25 -39.69 91.27 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.851 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -50.13 -29.61 9.48 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.079 0.466 . . . . 0.0 110.185 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.6 ' C ' HD13 ' A' ' 8' ' ' LEU . 1.8 tm? -87.66 -29.35 21.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.281 179.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.686 ' HB3' HD11 ' A' ' 41' ' ' ILE . 11.1 mt -67.74 -35.54 78.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.563 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -51.78 -47.8 64.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.664 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -49.16 -46.29 45.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.26 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.907 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -55.46 -58.71 6.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.762 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.527 ' HA ' HD23 ' A' ' 16' ' ' LEU . 40.2 tt0 -55.16 -37.73 67.37 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.336 -179.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -76.41 -26.46 55.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.87 0.367 . . . . 0.0 110.175 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.874 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -69.87 -27.28 32.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.345 179.31 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.712 ' CD1' HD13 ' A' ' 19' ' ' LEU . 2.7 mm? -62.63 -40.39 96.83 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.179 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -41.24 -39.74 1.43 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.069 0.462 . . . . 0.0 110.54 179.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.668 ' HB3' HG23 ' A' ' 81' ' ' THR . 1.1 m-20 -70.7 -47.04 61.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.528 178.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.912 HD21 HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -47.67 -40.81 20.88 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.392 179.806 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 1.091 ' CE1' HD12 ' A' ' 30' ' ' LEU . 63.5 m-70 -52.48 -39.29 61.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.908 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.542 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 3.9 mmpt? -86.88 5.07 38.7 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -177.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.528 ' HB2' HG21 ' A' ' 81' ' ' THR . 39.1 m-20 -152.97 19.93 0.58 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.745 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.824 ' CB ' HD12 ' A' ' 71' ' ' LEU . 0.8 OUTLIER -84.84 -31.17 23.95 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.645 179.156 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.504 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 84.6 t60 -178.44 -52.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.541 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.23 -87.0 0.3 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.94 -0.647 . . . . 0.0 111.827 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -136.15 -145.52 5.07 Favored Glycine 0 N--CA 1.442 -0.931 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.605 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.436 ' HD2' ' CE1' ' A' ' 20' ' ' HIS . 1.2 ttpt -94.1 -20.88 19.5 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.603 0.24 . . . . 0.0 111.339 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -52.29 -53.85 38.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.557 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -79.41 -27.21 41.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.317 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.091 HD12 ' CE1' ' A' ' 20' ' ' HIS . 2.1 tm? -75.24 -29.28 60.18 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -49.05 -38.29 23.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.653 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -75.91 -23.57 55.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.715 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.911 ' CG1' HG13 ' A' ' 67' ' ' VAL . 0.9 OUTLIER -87.26 -58.16 3.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.831 179.764 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.62 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -59.32 -24.23 63.14 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.898 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.433 ' O ' ' HB2' ' A' ' 39' ' ' ASN . 1.0 OUTLIER -56.67 -44.3 81.28 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 177.816 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.821 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.8 m-70 -57.82 -49.61 76.08 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 177.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.967 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -57.4 -66.64 0.43 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.591 178.536 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.68 ' O ' HG22 ' A' ' 41' ' ' ILE . 0.3 OUTLIER -46.46 -41.99 14.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.684 -179.59 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 35' ' ' ASN . 2.1 t-20 -68.52 -26.02 65.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.875 0.369 . . . . 0.0 110.615 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 1.059 HG12 HD11 ' A' ' 44' ' ' ILE . 53.8 t -77.32 -37.71 25.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.525 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.686 HD11 ' HB3' ' A' ' 9' ' ' LEU . 4.8 tp -48.17 -37.31 7.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 120.995 0.426 . . . . 0.0 110.664 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -75.67 -41.21 54.47 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.699 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.411 ' HB3' ' HE3' ' A' ' 60' ' ' MET . 4.0 m-20 -60.53 -30.23 69.62 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 1.059 HD11 HG12 ' A' ' 40' ' ' VAL . 4.0 mt -86.54 -41.93 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.886 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 25.8 m170 -62.44 -43.97 97.54 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.273 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -73.89 -11.22 60.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.076 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.48 ' CD1' ' C ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -85.43 -42.03 14.87 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.76 179.781 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.537 ' CE ' HD12 ' A' ' 9' ' ' LEU . 1.6 tpp -45.73 -27.74 0.88 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.925 -179.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.86 19.96 10.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.788 0.328 . . . . 0.0 111.763 -179.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 75.85 33.16 51.79 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.644 -0.788 . . . . 0.0 113.121 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -95.19 40.24 2.71 Favored Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 109.961 -1.255 . . . . 0.0 109.961 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 123.11 21.29 2.59 Favored Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 114.503 -0.849 . . . . 0.0 111.015 -178.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.439 ' HA ' ' CD1' ' A' ' 47' ' ' PHE . 33.4 p -61.36 166.09 4.17 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.088 0.471 . . . . 0.0 111.433 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.671 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . 51.36 51.38 37.1 Favored Glycine 0 N--CA 1.452 -0.284 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.909 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.402 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . 171.61 -33.83 0.14 Allowed Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.288 -0.958 . . . . 0.0 113.192 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.581 ' HD3' ' N ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -88.41 -26.19 22.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.874 0.337 . . . . 0.0 111.689 -179.491 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.581 ' N ' ' HD3' ' A' ' 56' ' ' LYS . 19.7 tp -70.12 -8.14 47.2 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.575 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 55' ' ' GLY . 17.3 pt20 -86.39 -49.88 7.31 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.924 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.4 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 3.8 mt-10 -86.88 -34.1 19.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.447 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.496 ' HG3' HG13 ' A' ' 40' ' ' VAL . 8.7 tpp -74.22 -29.51 61.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.551 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.508 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 5.9 ttm -56.06 -50.74 70.12 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.978 0.418 . . . . 0.0 110.138 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -59.52 -20.87 58.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.824 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.631 ' HB3' HG21 ' A' ' 40' ' ' VAL . 0.7 OUTLIER -71.83 -33.2 68.28 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.043 179.935 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.474 ' CE2' ' HG3' ' A' ' 61' ' ' MET . 1.1 p90 -84.08 -25.81 29.5 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 120.983 0.42 . . . . 0.0 110.068 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -35.33 27.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.256 178.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.08 -32.44 61.95 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.445 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.967 HG21 ' HB2' ' A' ' 37' ' ' LEU . 96.3 t -58.84 -38.74 74.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.005 179.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.996 HD21 HG13 ' A' ' 85' ' ' ILE . 0.7 OUTLIER -78.62 -4.33 48.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.233 178.453 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -76.41 -56.74 4.35 Favored 'General case' 0 CA--C 1.521 -0.14 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.604 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 3.1 tp10 -54.02 -36.62 63.2 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.99 0.9 . . . . 0.0 108.674 177.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.925 HD21 HG13 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -74.73 -69.64 0.45 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 113.553 -1.658 . . . . 0.0 112.168 -179.223 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.41 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 42.2 t-20 -50.16 -26.14 4.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.633 -179.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -87.27 7.82 26.86 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.428 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.499 ' O ' ' N ' ' A' ' 76' ' ' GLN . 5.7 m-70 -155.38 34.51 0.37 Allowed 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.582 ' CD2' HG21 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -51.23 90.34 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.105 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.029 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.499 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -65.64 68.3 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.536 -177.965 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 57.45 29.67 60.87 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.646 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.553 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -136.86 46.14 1.04 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.476 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.46 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.7 OUTLIER -52.67 -38.99 61.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.751 0.31 . . . . 0.0 111.224 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -49.58 -32.45 12.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.568 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.668 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -69.03 -74.16 0.13 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.925 HG13 HD21 ' A' ' 71' ' ' LEU . 22.6 t -49.46 -39.19 13.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.914 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.453 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.3 OUTLIER -49.02 -41.51 34.97 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 179.234 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -76.43 -28.92 56.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.694 178.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.996 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.57 -33.41 7.68 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.346 -179.579 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -74.43 -43.06 57.91 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 179.115 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -62.49 -29.33 70.46 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.716 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.8 m-80 -82.92 -57.05 3.47 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.443 179.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.972 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -63.51 -51.15 74.15 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.347 -179.675 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.493 ' N ' HG22 ' A' ' 89' ' ' ILE . 5.8 mmtp -59.15 -27.53 65.73 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.119 -0.632 . . . . 0.0 109.782 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -90.72 -2.22 57.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.146 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.716 HD13 ' O ' ' A' ' 88' ' ' ASN . 0.9 OUTLIER -78.44 -46.62 25.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.339 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.639 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -52.5 -27.56 16.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.41 178.927 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.639 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.2 OUTLIER -65.16 -64.06 0.95 Allowed 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.661 -179.586 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.462 ' O ' HD21 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -61.36 -11.51 10.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.993 178.328 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.589 HD11 HD21 ' A' ' 9' ' ' LEU . 24.7 mt -89.34 -65.39 1.02 Allowed 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 120.949 0.404 . . . . 0.0 110.587 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.451 ' N ' HD21 ' A' ' 57' ' ' LEU . 25.4 tt0 -64.16 -14.24 53.78 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.176 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 11.2 tt0 -83.33 -24.87 31.94 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.524 179.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 1.089 HD13 HD23 ' A' ' 5' ' ' LEU . 31.4 tp -70.82 -61.48 1.75 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.744 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.671 HG11 ' HA2' ' A' ' 54' ' ' GLY . 22.7 t -65.56 -31.58 54.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.137 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -100.46 32.8 2.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.99 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.915 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.863 -0.095 . . . . 0.0 112.863 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.7 tptm -63.8 -15.62 59.2 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.705 0.252 . . . . 0.0 111.232 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.831 HD11 ' HB3' ' A' ' 95' ' ' HIS . 0.1 OUTLIER -54.17 -22.15 10.59 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.861 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.48 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 20.5 p-10 -54.41 -45.24 72.92 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.649 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.16 -33.63 19.68 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.296 0.57 . . . . 0.0 109.539 178.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.587 ' C ' HD13 ' A' ' 8' ' ' LEU . 1.7 tm? -87.85 -30.46 20.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.01 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.938 HD12 ' HE3' ' A' ' 48' ' ' MET . 0.4 OUTLIER -65.89 -38.09 87.84 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.082 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -50.51 -40.76 52.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.229 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -47.07 -42.17 18.28 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.075 0.464 . . . . 0.0 110.485 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.015 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -57.31 -61.14 2.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.268 179.234 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.737 ' H ' HD23 ' A' ' 12' ' ' LEU . 1.1 tm0? -50.63 -38.49 46.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.054 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.81 -31.04 61.6 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.832 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -64.97 -29.85 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.735 178.85 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.679 HD21 HD11 ' A' ' 89' ' ' ILE . 3.2 mm? -63.84 -28.43 69.85 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.092 178.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -48.95 -40.97 32.41 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-O 121.155 0.502 . . . . 0.0 110.041 179.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.779 ' HB3' HG23 ' A' ' 81' ' ' THR . 8.7 m120 -72.41 -45.67 58.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.79 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.928 HD12 HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -43.93 -49.25 8.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.592 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.735 ' CD2' HD12 ' A' ' 30' ' ' LEU . 43.9 m80 -45.79 -39.38 8.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.098 -179.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.468 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 4.3 mmpt? -91.17 6.62 44.36 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -177.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.506 ' O ' HD13 ' A' ' 75' ' ' LEU . 3.0 m-80 -146.5 10.84 1.11 Allowed 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.497 -0.481 . . . . 0.0 112.279 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.922 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -82.07 -35.31 28.8 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.789 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.477 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 85.7 t60 -179.13 -51.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.009 0.433 . . . . 0.0 110.726 179.518 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -134.59 -93.72 0.47 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.903 -0.665 . . . . 0.0 111.747 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -129.13 -148.03 6.5 Favored Glycine 0 N--CA 1.44 -1.081 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.443 ' HD3' ' CE1' ' A' ' 31' ' ' HIS . 7.9 ttmt -94.35 -15.72 24.13 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.626 0.25 . . . . 0.0 111.476 179.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -55.91 -52.28 64.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.862 0.363 . . . . 0.0 111.027 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -81.97 -28.57 32.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.598 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.922 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.4 tm? -70.59 -32.24 69.54 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 178.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.443 ' CE1' ' HD3' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -44.51 -55.12 5.36 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.051 179.904 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -20.41 62.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.117 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.98 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.0 OUTLIER -90.01 -60.25 2.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.716 179.799 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.577 ' H ' HD13 ' A' ' 30' ' ' LEU . 1.0 OUTLIER -62.88 -25.62 68.39 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.182 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.412 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 10.8 t-20 -54.7 -37.72 66.15 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 177.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.893 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -66.15 -49.61 66.81 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.139 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.952 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -53.09 -67.74 0.23 Allowed 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.824 178.595 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.486 ' O ' HG22 ' A' ' 41' ' ' ILE . 24.2 tt0 -46.25 -43.18 15.32 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.262 -179.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -63.73 -24.09 67.63 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.761 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 36' ' ' HIS . 50.8 t -70.55 -56.02 12.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.695 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.775 HD12 HD22 ' A' ' 9' ' ' LEU . 0.1 OUTLIER -44.27 -39.75 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.965 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 3.3 pt-20 -71.15 -32.37 68.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.342 . . . . 0.0 110.404 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.547 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -79.04 -27.04 43.12 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.766 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.702 ' CD1' HG12 ' A' ' 40' ' ' VAL . 20.6 mt -86.92 -26.11 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.109 178.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.466 ' NE2' HG13 ' A' ' 41' ' ' ILE . 20.3 m170 -77.88 -57.5 3.77 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.865 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.28 -25.66 67.25 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.072 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.547 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.9 m-85 -88.98 -28.13 20.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.665 179.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.938 ' HE3' HD12 ' A' ' 9' ' ' LEU . 1.9 ttt -49.46 -28.56 5.43 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.583 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -29.62 43.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.063 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 129.85 -6.3 6.13 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.905 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.45 -29.78 7.66 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.144 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.438 ' HA3' ' CE2' ' A' ' 47' ' ' PHE . . . -157.73 23.0 0.41 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.287 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.5 p -59.97 165.5 3.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.815 0.341 . . . . 0.0 110.543 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.664 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . 66.46 51.13 44.97 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.531 -0.842 . . . . 0.0 111.995 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 161.19 -24.07 0.24 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.42 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.486 ' HZ3' HD13 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -84.27 -43.19 15.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.682 0.277 . . . . 0.0 111.134 179.854 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.533 ' O ' ' CB ' ' A' ' 61' ' ' MET . 14.3 tp -65.21 -9.66 25.3 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -86.44 -50.34 6.95 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.793 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -87.33 -31.73 20.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.894 0.378 . . . . 0.0 110.594 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.76 ' HG3' HG13 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -78.19 -28.01 48.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.089 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.533 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.5 OUTLIER -59.32 -41.45 89.09 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.071 179.656 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -71.15 -15.73 62.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.083 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.439 ' HG2' HG22 ' A' ' 40' ' ' VAL . 0.9 OUTLIER -80.96 -25.93 36.99 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.273 -179.81 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.61 ' HB3' HG11 ' A' ' 40' ' ' VAL . 1.2 p90 -86.91 -33.82 19.59 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 121.03 0.443 . . . . 0.0 110.039 179.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.455 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 10.5 tt0 -79.14 -35.67 41.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.731 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.6 tp60 -54.06 -33.5 57.63 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.969 0.414 . . . . 0.0 110.477 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.98 HG13 ' CG1' ' A' ' 33' ' ' VAL . 71.8 t -59.41 -39.5 79.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.217 179.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 1.031 HD21 HG13 ' A' ' 85' ' ' ILE . 0.5 OUTLIER -76.19 -5.67 47.82 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.394 178.68 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -75.68 -56.87 4.27 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.487 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 0.5 OUTLIER -53.57 -38.12 63.58 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 122.143 0.973 . . . . 0.0 108.674 177.594 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.958 HD21 HG13 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -72.41 -67.36 0.56 Allowed 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 113.434 -1.712 . . . . 0.0 111.848 -179.345 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.422 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 65.9 t30 -51.04 -26.08 5.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.508 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -88.11 9.38 22.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.367 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.502 ' O ' ' N ' ' A' ' 76' ' ' GLN . 73.0 m-70 -154.97 32.31 0.4 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 111.768 0.284 . . . . 0.0 111.768 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.568 HD21 ' HB ' ' A' ' 82' ' ' VAL . 0.2 OUTLIER -52.67 88.31 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.086 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.502 ' N ' ' O ' ' A' ' 74' ' ' HIS . 1.2 mm-40 -67.97 69.7 0.13 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.441 . . . . 0.0 111.171 -178.281 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 60.88 21.57 58.88 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.584 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.559 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -121.94 39.41 2.33 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.312 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.467 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -49.26 -40.65 35.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.866 0.365 . . . . 0.0 111.469 -179.767 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 1.9 m170 -55.43 -33.9 63.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.58 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.779 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.3 m -67.45 -74.41 0.12 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.958 HG13 HD21 ' A' ' 71' ' ' LEU . 39.7 t -51.12 -40.73 22.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.083 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.469 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 56.6 t-80 -49.84 -40.88 43.75 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -76.54 -28.35 56.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.635 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 1.031 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.3 -33.13 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.962 -179.589 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.506 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.2 OUTLIER -74.38 -46.53 39.82 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.851 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.35 -30.28 66.61 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.796 ' O ' HD13 ' A' ' 92' ' ' ILE . 2.5 m-80 -82.75 -68.15 0.73 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.335 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 1.015 ' CG1' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -50.53 -45.76 26.47 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.473 -179.761 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.414 ' N ' HG22 ' A' ' 89' ' ' ILE . 1.2 mmmm -62.53 -30.21 71.12 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.734 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -90.75 -2.32 57.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.278 178.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.796 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -78.68 -35.63 18.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.634 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -65.37 -30.81 71.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.506 179.177 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.634 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.1 OUTLIER -59.88 -57.09 14.38 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.318 -179.207 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.831 ' HB3' HD11 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -69.81 -9.96 56.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.387 178.87 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.676 HD21 ' HG ' ' A' ' 9' ' ' LEU . 35.5 mt -89.43 -54.24 4.18 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.456 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.405 ' HG2' HD23 ' A' ' 57' ' ' LEU . 1.6 mt-10 -62.97 -13.15 31.36 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 177.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.43 ' O ' ' CB ' ' A' ' 102' ' ' ARG . 0.1 OUTLIER -80.75 -1.3 42.22 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.836 179.383 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.668 HD21 ' HB2' ' A' ' 5' ' ' LEU . 4.1 mt -96.1 -67.2 0.86 Allowed 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.127 0.489 . . . . 0.0 110.597 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.664 HG11 ' HA2' ' A' ' 54' ' ' GLY . 41.3 t -59.78 -27.45 38.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.946 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 97' ' ' GLU . 10.9 t-80 -86.91 -33.08 19.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.107 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.43 ' CB ' ' O ' ' A' ' 98' ' ' GLU . 38.2 ttp180 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.952 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.48 ' HA2' ' HG3' ' A' ' 48' ' ' MET . . . . . . . . 0 N--CA 1.45 -0.381 0 N-CA-C 112.609 -0.196 . . . . 0.0 112.609 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.7 tptt -55.87 -19.55 12.25 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.54 0.17 . . . . 0.0 111.241 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.863 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -49.65 -23.51 1.76 Allowed 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.35 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.422 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 12.2 p30 -58.42 -42.74 87.9 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.742 178.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -48.81 -30.6 5.91 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.273 0.558 . . . . 0.0 109.752 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.835 ' O ' HD13 ' A' ' 8' ' ' LEU . 2.2 tm? -83.64 -35.58 24.49 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.933 178.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.678 ' HB3' HD11 ' A' ' 41' ' ' ILE . 7.9 mt -62.23 -40.95 97.87 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.82 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -49.0 -44.26 40.99 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.683 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.407 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 0.9 OUTLIER -49.71 -45.74 49.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.101 -179.821 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.954 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -56.54 -61.64 2.28 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.717 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.574 ' H ' HD23 ' A' ' 12' ' ' LEU . 4.0 tm0? -51.53 -39.3 57.44 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.481 -179.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -75.53 -28.77 59.2 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.856 HG13 ' HB ' ' A' ' 85' ' ' ILE . 0.3 OUTLIER -67.69 -27.42 38.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.976 179.031 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.711 ' CD1' HD13 ' A' ' 19' ' ' LEU . 2.9 mm? -64.8 -29.7 70.68 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.722 178.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.433 ' HA ' ' ND1' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -47.51 -39.95 17.42 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.21 0.529 . . . . 0.0 110.075 179.277 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.859 ' HB3' HG23 ' A' ' 81' ' ' THR . 2.1 m120 -73.82 -45.49 51.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.072 178.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.858 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -46.9 -42.95 18.39 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.618 -179.836 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.761 ' CD2' HD12 ' A' ' 30' ' ' LEU . 40.5 m80 -48.81 -40.82 30.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.869 0.366 . . . . 0.0 111.734 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.5 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 3.9 mmpt? -89.2 5.78 43.17 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.697 ' O ' HD13 ' A' ' 75' ' ' LEU . 3.8 m120 -142.03 5.21 1.7 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.468 -0.493 . . . . 0.0 112.274 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.912 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -81.07 -51.91 7.97 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.738 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.518 ' HB3' ' CZ2' ' A' ' 23' ' ' TRP . 8.7 t-160 179.56 58.67 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.939 0.4 . . . . 0.0 110.876 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 116.72 -104.05 1.18 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.061 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -128.81 -146.24 6.14 Favored Glycine 0 N--CA 1.443 -0.9 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.961 179.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.49 ' HG3' ' CD2' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -94.18 -13.28 26.84 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -49.14 -62.66 1.41 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.8 m-80 -77.32 -27.83 53.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.695 0.283 . . . . 0.0 110.728 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.912 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.3 tm? -68.37 -31.18 70.37 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.449 ' N ' ' O ' ' A' ' 27' ' ' LYS . 3.8 t-80 -45.25 -58.69 3.1 Favored 'General case' 0 CA--C 1.523 -0.091 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.803 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.4 -21.99 52.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.015 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.96 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.5 t -87.09 -64.93 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.691 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.616 ' H ' HD13 ' A' ' 30' ' ' LEU . 1.1 t70 -59.46 -21.67 60.41 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -59.8 -39.84 86.35 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.982 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.3 m-70 -63.51 -52.57 60.64 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 177.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.949 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -54.59 -67.31 0.28 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.684 178.328 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.807 ' O ' HG22 ' A' ' 41' ' ' ILE . 1.8 tt0 -47.41 -43.49 23.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.182 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -66.86 -25.2 66.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.546 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.982 HG23 ' O ' ' A' ' 36' ' ' HIS . 81.3 t -75.21 -39.86 43.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.807 HG22 ' O ' ' A' ' 38' ' ' GLN . 6.9 tp -43.23 -35.45 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.184 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -75.86 -40.82 53.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.192 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.792 ' OD2' HG13 ' A' ' 40' ' ' VAL . 4.2 p30 -62.14 -30.79 71.28 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.583 HG13 ' O ' ' A' ' 40' ' ' VAL . 2.3 mt -86.84 -40.55 14.14 Favored 'Isoleucine or valine' 0 C--N 1.337 0.051 0 CA-C-O 121.043 0.449 . . . . 0.0 109.972 178.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.406 ' NE2' HG13 ' A' ' 41' ' ' ILE . 18.6 m170 -59.39 -40.97 88.26 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.423 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -82.59 -10.02 59.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.803 178.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.533 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -87.8 -36.7 17.13 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.161 -179.847 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.48 ' HG3' ' HA2' ' A' ' 3' ' ' GLY . 10.2 ptt? -49.06 -28.8 4.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.296 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -79.07 -21.48 46.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.469 -179.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 117.29 -6.22 17.05 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.558 -0.829 . . . . 0.0 113.04 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.43 -28.62 6.66 Favored Glycine 0 C--N 1.334 0.422 0 C-N-CA 120.571 -0.823 . . . . 0.0 112.078 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -156.09 27.67 0.57 Allowed Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.521 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 25.8 p -74.0 148.37 42.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.025 0.44 . . . . 0.0 111.381 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 74.42 52.96 7.02 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 115.703 -0.681 . . . . 0.0 112.762 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 162.74 -35.03 0.33 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.386 -0.912 . . . . 0.0 113.274 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.48 ' HE2' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -88.35 -38.96 14.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.95 0.375 . . . . 0.0 111.759 -179.478 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.557 ' O ' ' HB3' ' A' ' 61' ' ' MET . 47.1 tp -60.51 -10.91 5.65 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.51 ' O ' ' HG3' ' A' ' 61' ' ' MET . 3.8 pt20 -85.74 -49.33 8.03 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.837 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.41 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 3.7 mt-10 -87.58 -28.94 21.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.95 0.405 . . . . 0.0 110.328 179.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.402 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -77.18 -33.92 56.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.91 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.557 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -53.64 -41.43 66.73 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.106 0.479 . . . . 0.0 110.389 179.748 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 19.1 mmtt -57.75 -24.21 55.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.939 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.651 ' HB3' HG21 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -68.75 -42.91 76.88 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.424 -179.785 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.853 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.7 p90 -69.92 -29.66 66.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.923 0.392 . . . . 0.0 110.421 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -82.41 -30.58 30.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.41 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.59 -41.25 73.1 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.605 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.96 HG13 ' CG1' ' A' ' 33' ' ' VAL . 14.6 t -56.15 -50.09 72.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.027 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 1.016 HD21 HG13 ' A' ' 85' ' ' ILE . 0.4 OUTLIER -63.13 -16.38 59.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.618 179.13 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -65.62 -61.19 2.23 Favored 'General case' 0 C--O 1.231 0.097 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.476 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -51.06 -36.59 40.74 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.906 0.86 . . . . 0.0 109.401 178.175 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.895 HD21 HG13 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -70.68 -69.11 0.38 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 113.745 -1.57 . . . . 0.0 112.336 -178.884 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.418 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 2.6 m-20 -50.25 -26.26 4.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.56 -179.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -88.69 9.8 23.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.506 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.625 ' O ' ' N ' ' A' ' 76' ' ' GLN . 79.0 m-70 -153.82 28.72 0.47 Allowed 'General case' 0 CA--C 1.52 -0.18 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.697 HD13 ' O ' ' A' ' 22' ' ' ASN . 0.3 OUTLIER -49.38 85.3 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.016 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.625 ' N ' ' O ' ' A' ' 74' ' ' HIS . 16.9 mm-40 -82.05 -37.74 26.0 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.052 -177.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -83.75 -58.07 2.32 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.223 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 174.53 121.82 0.65 Allowed Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.231 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.572 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 1.3 mtmt -42.75 -30.41 0.38 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -43.18 -35.02 1.25 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.76 0.314 . . . . 0.0 111.417 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.859 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.4 m -69.93 -74.23 0.14 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.895 HG13 HD21 ' A' ' 71' ' ' LEU . 27.3 t -48.58 -38.44 9.45 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.403 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.098 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.472 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 1.3 t-80 -50.77 -41.29 56.65 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -76.2 -28.14 57.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.624 178.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 1.016 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.67 -33.6 7.79 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.14 -179.748 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.554 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -75.3 -45.42 39.9 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.801 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.466 ' O ' ' HB2' ' A' ' 91' ' ' GLU . 1.5 mp0 -59.62 -29.66 68.15 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 178.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.732 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.9 m-80 -82.96 -63.58 1.34 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.438 179.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 1.003 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -55.03 -43.77 71.12 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.22 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.468 -179.73 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -63.37 -29.32 70.65 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.133 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 87' ' ' GLN . 0.4 OUTLIER -90.39 -6.81 54.53 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.102 178.522 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.732 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -72.9 -42.25 60.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.638 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -58.47 -27.65 64.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.365 178.763 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.638 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.0 OUTLIER -62.47 -63.88 1.09 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.169 -179.222 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.653 ' HB3' HD11 ' A' ' 5' ' ' LEU . 11.8 m80 -64.21 -10.5 23.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.144 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.596 HD11 HD21 ' A' ' 9' ' ' LEU . 31.3 mt -88.52 -55.57 3.67 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.086 0.47 . . . . 0.0 110.061 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.416 ' N ' HD21 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -72.9 -7.88 53.0 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.932 178.7 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -90.96 -25.26 19.84 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.758 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.863 HD13 HD23 ' A' ' 5' ' ' LEU . 15.9 tp -70.17 -52.77 20.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.157 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 33.4 t -69.64 -27.99 35.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.423 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -77.51 -38.58 48.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.761 0.315 . . . . 0.0 110.975 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.953 -179.897 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.181 -0.368 . . . . 0.0 112.181 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.77 -16.67 61.77 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 120.567 0.222 . . . . 0.0 110.589 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 1.043 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -51.39 -23.92 4.31 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 177.878 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.512 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 23.4 t-20 -63.64 -46.51 85.36 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.612 178.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -48.62 -35.12 12.96 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.625 HD13 ' O ' ' A' ' 8' ' ' LEU . 2.5 tm? -88.07 -29.13 20.87 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.144 178.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.814 ' HG ' HD21 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -70.06 -33.03 71.42 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.056 0.455 . . . . 0.0 110.292 179.829 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -54.54 -40.68 68.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.235 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.459 ' HA ' ' HG2' ' A' ' 14' ' ' GLU . 0.4 OUTLIER -48.32 -43.77 33.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.931 0.396 . . . . 0.0 110.848 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.992 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -57.79 -60.53 3.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.768 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.638 ' H ' HD23 ' A' ' 12' ' ' LEU . 4.8 tp60 -51.47 -41.36 60.84 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.555 -179.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.459 ' HG2' ' HA ' ' A' ' 11' ' ' ASP . 10.8 pt-20 -74.21 -22.02 59.55 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.846 0.355 . . . . 0.0 110.203 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.865 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -74.21 -27.14 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.254 179.249 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.818 HD21 HD11 ' A' ' 89' ' ' ILE . 3.1 mm? -65.54 -34.62 78.68 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.356 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.82 -42.99 8.35 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 121.104 0.478 . . . . 0.0 110.247 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.668 ' HB3' HG23 ' A' ' 81' ' ' THR . 0.3 OUTLIER -68.35 -42.86 78.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.477 0.656 . . . . 0.0 109.263 178.595 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.875 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -53.66 -37.05 62.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.814 179.683 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.989 ' CE1' HD12 ' A' ' 30' ' ' LEU . 49.3 m-70 -54.04 -34.48 60.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.386 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.537 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.4 mmpt? -94.29 3.39 55.28 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -138.91 -1.43 1.79 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.94 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -72.88 -56.02 5.79 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.21 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.588 ' HB3' ' CH2' ' A' ' 23' ' ' TRP . 8.2 t-160 179.04 47.18 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.843 178.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 51.26 172.57 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.106 -0.569 . . . . 0.0 113.205 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.6 78.92 0.13 Allowed Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 121.012 -0.614 . . . . 0.0 112.283 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -27.05 5.52 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.95 -30.65 66.14 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.85 178.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -78.81 -40.51 32.77 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.989 HD12 ' CE1' ' A' ' 20' ' ' HIS . 1.1 tm? -65.97 -36.38 83.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.383 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.43 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.3 OUTLIER -46.48 -43.43 16.71 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.239 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.5 -21.3 55.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.467 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.867 HG11 HD22 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -88.3 -46.36 15.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.11 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.515 ' HB2' HD11 ' A' ' 30' ' ' LEU . 2.6 t0 -74.58 -34.33 62.86 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 179.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 2.3 t30 -53.28 -29.17 31.81 Favored 'General case' 0 C--N 1.334 -0.077 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.814 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -57.05 -52.95 63.22 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.806 178.815 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.805 ' CD1' HD21 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -77.1 -32.71 56.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.826 178.825 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.592 ' O ' HG22 ' A' ' 41' ' ' ILE . 2.2 tm0? -54.96 -37.47 66.53 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -83.42 -18.3 39.18 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.952 178.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.814 HG23 ' O ' ' A' ' 36' ' ' HIS . 55.3 t -75.97 -40.81 38.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.125 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.592 HG22 ' O ' ' A' ' 38' ' ' GLN . 2.3 tp -45.53 -35.9 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.278 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.568 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 0.4 OUTLIER -75.56 -28.03 58.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.561 179.546 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 1.3 m-20 -79.38 -26.32 42.01 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.737 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.636 HD11 HG12 ' A' ' 40' ' ' VAL . 2.8 mt -86.17 -57.69 4.08 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.856 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.568 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -58.76 -27.31 64.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.04 -179.948 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.503 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 27.6 t0 -86.67 -26.36 24.35 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.568 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.9 m-85 -83.74 -52.49 6.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.273 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.509 ' SD ' HG22 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -51.97 -21.64 3.23 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.399 -179.411 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.08 16.09 10.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.348 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 102.41 31.99 5.04 Favored Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.89 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.41 ' CA ' ' HA ' ' A' ' 47' ' ' PHE . . . -111.22 24.98 14.71 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.614 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.72 25.74 9.63 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.643 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -20.02 55.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.636 0.255 . . . . 0.0 111.235 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.624 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -77.02 70.86 2.28 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.982 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.47 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . 133.64 -7.33 4.91 Favored Glycine 0 CA--C 1.518 0.223 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.953 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.926 ' NZ ' HD22 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -88.73 -37.48 15.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.669 0.271 . . . . 0.0 111.213 -179.89 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.926 HD22 ' NZ ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -63.59 -11.98 29.29 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.248 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 1.7 pp0? -86.03 -49.92 7.44 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.551 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -86.92 -30.46 21.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.753 0.311 . . . . 0.0 110.576 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.602 ' HG2' HG13 ' A' ' 40' ' ' VAL . 0.6 OUTLIER -77.88 -31.06 51.13 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.753 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.482 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -55.17 -33.82 63.3 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.896 0.379 . . . . 0.0 110.489 179.771 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 66' ' ' GLN . 31.3 tttt -67.39 -26.15 66.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.092 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.746 ' HB3' HG21 ' A' ' 40' ' ' VAL . 2.4 tp10 -70.51 -37.25 74.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.692 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.483 ' HA ' ' HB2' ' A' ' 37' ' ' LEU . 0.3 OUTLIER -85.09 -27.8 26.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.939 0.4 . . . . 0.0 110.438 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -82.45 -29.9 30.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.231 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.407 ' HB2' ' O ' ' A' ' 62' ' ' LYS . 1.1 tm0? -62.7 -36.09 81.83 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.597 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.818 HG22 ' O ' ' A' ' 33' ' ' VAL . 72.1 t -52.18 -39.97 28.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.7 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 1.06 HD21 HG13 ' A' ' 85' ' ' ILE . 1.0 OUTLIER -73.67 -5.3 39.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.004 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' A' ' 66' ' ' GLN . 2.2 m-20 -78.08 -56.38 4.52 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.507 ' CB ' HG21 ' A' ' 33' ' ' VAL . 4.8 tp10 -52.43 -32.5 39.66 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 122.029 0.919 . . . . 0.0 108.788 177.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.875 HD13 ' CG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -79.13 -64.98 1.06 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.883 -179.106 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.425 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 65.2 t30 -50.46 -24.73 3.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.748 -179.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -88.74 3.89 49.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.817 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.497 ' O ' ' N ' ' A' ' 76' ' ' GLN . 91.3 m-70 -147.19 26.97 1.06 Allowed 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.577 HD11 HG23 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -49.5 91.95 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.027 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 74' ' ' HIS . 13.2 tt0 -64.54 68.23 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.594 -178.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 56.33 29.08 56.19 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.666 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.465 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -138.96 48.92 0.84 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.385 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.536 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -55.42 -36.09 66.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.541 0.21 . . . . 0.0 111.496 -179.764 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -45.26 -32.87 2.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.636 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.668 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -69.69 -74.64 0.13 Allowed 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.849 HG13 HD21 ' A' ' 71' ' ' LEU . 38.3 t -48.83 -38.81 10.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.98 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.473 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -50.26 -41.57 50.63 Favored 'General case' 0 CA--C 1.522 -0.12 0 CA-C-O 121.145 0.498 . . . . 0.0 109.713 179.405 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -76.16 -27.21 56.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.564 178.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 1.06 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.52 -35.76 10.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.074 -179.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -71.24 -44.69 64.83 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.477 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.405 ' NE2' ' HA ' ' A' ' 87' ' ' GLN . 3.8 mm-40 -61.53 -29.05 69.75 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.729 ' O ' HD13 ' A' ' 92' ' ' ILE . 2.1 m-80 -83.01 -64.75 1.11 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.222 178.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.992 ' CG1' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -54.12 -50.85 52.01 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.41 -179.745 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.433 ' N ' HG22 ' A' ' 89' ' ' ILE . 7.2 mmmt -59.78 -29.5 68.24 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.007 -0.677 . . . . 0.0 109.725 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -90.83 -3.23 57.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.361 178.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.729 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -78.69 -40.09 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.633 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -60.01 -26.41 66.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.298 178.886 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.633 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 4.0 t60 -62.35 -65.44 0.69 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.157 -179.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.507 ' HB3' HD11 ' A' ' 5' ' ' LEU . 1.5 m-70 -61.7 -10.71 9.24 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.207 178.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.814 HD21 ' HG ' ' A' ' 9' ' ' LEU . 44.2 mt -89.34 -63.5 1.28 Allowed 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.943 0.401 . . . . 0.0 110.566 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -67.87 -11.77 59.32 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.324 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.421 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 0.9 OUTLIER -89.7 -13.12 37.58 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.879 179.565 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 1.043 HD13 HD23 ' A' ' 5' ' ' LEU . 10.0 tp -82.01 -56.45 3.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.016 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.624 HG11 ' HA2' ' A' ' 54' ' ' GLY . 40.9 t -66.67 -43.77 90.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.499 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -59.86 -28.33 67.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.015 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 32.7 ttt-85 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.859 179.938 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 CA-C-O 120.442 -0.088 . . . . 0.0 112.9 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -87.96 -19.41 27.28 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.744 0.272 . . . . 0.0 110.74 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 1.038 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -54.62 -19.3 5.76 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.728 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -61.15 -44.9 96.59 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.961 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -49.75 -28.08 5.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.045 0.45 . . . . 0.0 110.139 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.714 ' O ' HD22 ' A' ' 8' ' ' LEU . 1.2 tm? -87.64 -28.24 21.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.409 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.519 HD11 HG21 ' A' ' 44' ' ' ILE . 8.7 mt -73.18 -38.6 66.1 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.858 0.361 . . . . 0.0 110.774 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -42.83 -32.85 0.67 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.446 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.0 -52.2 13.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.519 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.917 ' O ' HG12 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -50.98 -43.2 60.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.301 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.841 ' N ' HD13 ' A' ' 12' ' ' LEU . 2.0 tt0 -73.51 -38.08 65.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.626 0.251 . . . . 0.0 111.5 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -73.89 -27.58 61.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.08 0.467 . . . . 0.0 110.132 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.917 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.9 OUTLIER -64.83 -24.34 35.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.333 179.163 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.697 HD12 HD13 ' A' ' 19' ' ' LEU . 1.1 mm? -66.49 -37.94 86.17 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.237 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.48 -33.17 1.62 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 121.172 0.511 . . . . 0.0 110.288 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.475 ' HB3' HG23 ' A' ' 81' ' ' THR . 34.3 m-80 -76.79 -45.84 27.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.903 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.971 HD21 HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -47.85 -42.61 26.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.267 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 1.033 ' CE1' HD12 ' A' ' 30' ' ' LEU . 56.3 m-70 -48.43 -42.46 32.32 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.266 -0.424 . . . . 0.0 112.035 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.444 ' HE3' ' C ' ' A' ' 20' ' ' HIS . 0.0 OUTLIER -86.24 5.01 36.33 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -177.248 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.779 ' O ' HD13 ' A' ' 75' ' ' LEU . 9.0 m-80 -146.01 12.63 1.26 Allowed 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.383 -0.527 . . . . 0.0 112.135 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.802 ' CA ' HD12 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -84.78 -33.59 22.97 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.893 179.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.505 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 3.1 t-160 -178.32 -51.18 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.646 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.81 138.73 2.96 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.755 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.44 104.37 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.394 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.4 tttt -53.01 -23.79 8.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.697 0.284 . . . . 0.0 110.775 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -50.91 -31.94 19.15 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.804 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -85.99 -46.91 10.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.496 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.033 HD12 ' CE1' ' A' ' 20' ' ' HIS . 2.0 tm? -60.31 -29.96 69.19 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.404 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 17.0 t-160 -45.69 -56.44 5.25 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.694 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.12 -24.1 62.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.967 0.413 . . . . 0.0 110.779 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.982 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.3 t -84.66 -66.1 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.522 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.623 ' N ' HG12 ' A' ' 33' ' ' VAL . 1.0 OUTLIER -57.87 -23.25 52.2 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.298 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.404 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 16.3 m-20 -56.97 -39.44 74.61 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 177.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.702 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -66.54 -45.63 78.79 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.72 -1.127 . . . . 0.0 108.028 177.366 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.992 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -56.7 -67.13 0.34 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.794 178.612 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -44.58 -41.79 6.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.056 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -62.21 -29.8 70.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.299 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.847 HG11 ' HB3' ' A' ' 64' ' ' PHE . 97.6 t -62.54 -54.82 28.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.27 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.669 HD11 HD11 ' A' ' 12' ' ' LEU . 17.3 mm -42.5 -46.13 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.938 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 1.1 pt-20 -68.02 -29.86 68.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.884 0.373 . . . . 0.0 110.405 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.546 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.9 OUTLIER -81.39 -25.2 36.45 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.921 -0.582 . . . . 0.0 109.96 178.848 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.572 HG12 ' O ' ' A' ' 40' ' ' VAL . 9.1 mm -87.17 -38.19 11.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.67 179.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.638 ' NE2' HG23 ' A' ' 41' ' ' ILE . 11.6 m170 -78.03 -42.3 32.93 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.633 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -72.04 -27.6 62.81 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.82 0.343 . . . . 0.0 110.47 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.546 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.8 m-85 -88.48 -45.61 9.8 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.485 ' HE1' ' N ' ' A' ' 5' ' ' LEU . 8.1 ptm -46.7 -38.16 9.45 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 120.813 0.34 . . . . 0.0 111.443 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.47 -21.33 66.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.299 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 133.05 24.93 0.69 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.945 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -102.29 35.25 5.09 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.137 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.11 32.57 4.29 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.221 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.72 ' O ' HG11 ' A' ' 100' ' ' VAL . 88.8 p -59.61 -22.48 61.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.687 0.28 . . . . 0.0 111.107 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -91.91 75.1 1.44 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.52 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 145.26 -17.14 1.9 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.619 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.476 ' HE3' ' HB2' ' A' ' 47' ' ' PHE . 2.9 pptp? -88.21 -39.97 14.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.783 0.325 . . . . 0.0 110.915 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' A' ' 96' ' ' LEU . 7.0 tp -65.85 -9.38 28.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.943 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -86.15 -50.08 7.27 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.311 -0.556 . . . . 0.0 110.696 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -87.39 -30.68 20.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.474 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.803 ' HG3' HG13 ' A' ' 40' ' ' VAL . 17.5 tpp -78.14 -33.11 50.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.163 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.528 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 2.4 tmm? -56.12 -41.97 76.12 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 120.189 -0.604 . . . . 0.0 109.843 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.04 -26.69 65.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.918 178.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.463 ' HB3' HG22 ' A' ' 40' ' ' VAL . 0.7 OUTLIER -65.27 -34.4 78.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.049 179.929 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.847 ' HB3' HG11 ' A' ' 40' ' ' VAL . 0.9 OUTLIER -87.38 -26.46 23.31 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.851 0.358 . . . . 0.0 110.606 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -82.64 -32.41 28.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.826 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -57.41 -39.3 75.87 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.202 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.992 HG21 ' HB2' ' A' ' 37' ' ' LEU . 13.0 t -50.19 -44.67 23.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.005 0.431 . . . . 0.0 110.584 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 1.034 HD11 HD13 ' A' ' 89' ' ' ILE . 0.7 OUTLIER -66.25 -13.81 60.96 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.059 179.534 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -67.84 -58.61 4.3 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.494 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 1.9 tp10 -52.81 -37.51 60.04 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 122.0 0.905 . . . . 0.0 109.486 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.871 HD21 HG13 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -72.11 -69.4 0.4 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.652 -1.613 . . . . 0.0 112.565 -178.76 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.12 -26.69 4.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.687 -179.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -90.97 12.4 19.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.244 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.6 ' O ' ' N ' ' A' ' 76' ' ' GLN . 79.4 m-70 -156.33 30.08 0.34 Allowed 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.779 HD13 ' O ' ' A' ' 22' ' ' ASN . 0.2 OUTLIER -50.7 85.25 0.0 OUTLIER 'General case' 0 C--O 1.232 0.157 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.6 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -81.49 -37.54 27.76 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.837 -177.637 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -82.21 -65.85 1.61 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.783 -0.722 . . . . 0.0 113.183 -179.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -179.12 120.12 0.68 Allowed Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.171 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.51 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -40.08 -30.71 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.672 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -44.75 -34.46 2.28 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.848 0.356 . . . . 0.0 111.263 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.699 HG21 ' HB2' ' A' ' 22' ' ' ASN . 1.8 m -68.67 -73.26 0.15 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.871 HG13 HD21 ' A' ' 71' ' ' LEU . 24.3 t -50.24 -38.8 15.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.169 179.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.443 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -48.83 -40.83 30.84 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.401 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -76.2 -29.46 57.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.62 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.98 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.54 -35.4 9.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.36 -179.529 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -73.79 -39.62 64.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.697 0.284 . . . . 0.0 110.248 179.316 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.418 ' O ' ' CB ' ' A' ' 91' ' ' GLU . 2.3 mp0 -67.07 -31.05 71.28 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.497 ' O ' HD13 ' A' ' 92' ' ' ILE . 2.9 m-80 -83.02 -44.24 15.44 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.594 179.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 1.034 HD13 HD11 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -74.1 -54.87 13.88 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.564 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.275 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.569 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 5.9 mmmt -58.56 -28.98 66.02 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.224 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.418 ' CB ' ' O ' ' A' ' 87' ' ' GLN . 2.1 tt0 -90.92 -2.62 57.71 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.561 ' HB ' ' HA ' ' A' ' 89' ' ' ILE . 1.2 tp -78.82 -49.06 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.321 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.649 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.2 OUTLIER -48.29 -26.34 1.96 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.49 179.284 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.649 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 20.6 t-80 -65.1 -66.74 0.5 Allowed 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.816 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.493 ' HB3' HD11 ' A' ' 5' ' ' LEU . 1.0 OUTLIER -60.79 -12.79 11.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.982 -0.553 . . . . 0.0 109.894 178.242 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.602 ' HB3' HD21 ' A' ' 57' ' ' LEU . 22.1 mt -86.04 -64.96 1.07 Allowed 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 120.952 0.406 . . . . 0.0 110.133 179.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.543 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -62.31 -16.7 55.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.789 178.694 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -86.96 2.67 48.66 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.668 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 1.038 HD13 HD23 ' A' ' 5' ' ' LEU . 16.5 tp -100.81 -63.02 1.17 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.969 0.414 . . . . 0.0 110.796 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.72 HG11 ' O ' ' A' ' 53' ' ' SER . 39.8 t -61.86 -28.73 44.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.391 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 38.2 m170 -96.59 33.63 1.8 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.021 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.874 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.517 ' O ' ' HE3' ' A' ' 48' ' ' MET . . . . . . . . 0 N--CA 1.451 -0.353 0 N-CA-C 112.777 -0.129 . . . . 0.0 112.777 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 26.6 tptp -95.57 -21.17 18.43 Favored 'General case' 0 CA--C 1.507 -0.674 0 CA-C-O 120.599 0.237 . . . . 0.0 110.637 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.875 HD23 HD13 ' A' ' 99' ' ' LEU . 0.2 OUTLIER -52.04 -23.12 4.77 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.261 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.56 ' HB3' ' HE1' ' A' ' 48' ' ' MET . 26.4 p-10 -60.02 -40.18 88.42 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.569 178.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -49.84 -29.83 8.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.123 0.487 . . . . 0.0 110.027 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.617 ' C ' HD13 ' A' ' 8' ' ' LEU . 2.4 tm? -85.06 -31.25 23.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.247 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.999 HD23 HD22 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -68.3 -33.72 74.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.459 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -48.58 -45.51 38.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.324 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.413 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -57.38 -40.67 78.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.776 179.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.999 HD21 HD11 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -59.51 -63.4 1.32 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.747 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.89 ' HA ' HD23 ' A' ' 16' ' ' LEU . 13.0 tt0 -48.61 -41.17 30.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.617 -179.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -71.38 -30.12 65.76 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.101 0.477 . . . . 0.0 109.867 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.975 HG13 HG13 ' A' ' 85' ' ' ILE . 0.4 OUTLIER -66.11 -23.77 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.225 178.9 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 1.066 HD13 HD11 ' A' ' 85' ' ' ILE . 3.8 mm? -67.7 -33.92 75.86 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 177.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.422 ' HA ' ' CE ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -42.05 -42.16 2.8 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 121.189 0.518 . . . . 0.0 109.971 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.758 ' HB3' HG23 ' A' ' 81' ' ' THR . 6.4 m-20 -64.37 -49.11 72.94 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.258 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.892 HD12 HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -48.15 -57.16 6.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.719 -179.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 1.023 ' CE1' HD12 ' A' ' 30' ' ' LEU . 40.8 m-70 -45.25 -27.62 0.67 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.528 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.4 mmpt? -94.29 -20.09 20.1 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -177.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.477 ' O ' HD13 ' A' ' 75' ' ' LEU . 25.3 m120 -122.99 -6.25 8.43 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.997 ' CB ' HD12 ' A' ' 71' ' ' LEU . 0.2 OUTLIER -59.66 -33.28 71.34 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.894 -179.793 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.529 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 78.7 t60 -175.97 -52.65 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.566 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.5 129.35 1.73 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.844 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 71.55 115.09 0.05 OUTLIER Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.354 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -58.66 -18.61 32.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.569 0.224 . . . . 0.0 110.862 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -51.64 -38.1 53.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.627 0.251 . . . . 0.0 110.927 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -83.79 -44.63 14.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.466 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.023 HD12 ' CE1' ' A' ' 20' ' ' HIS . 1.4 tm? -62.1 -27.3 68.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.137 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -48.62 -36.09 15.05 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.627 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.11 -25.07 55.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.975 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.85 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.9 t -87.45 -56.67 5.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.758 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.637 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -59.02 -25.39 63.63 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.475 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -58.73 -40.41 83.69 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 178.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.885 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -63.48 -49.78 72.27 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 177.777 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.042 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -55.47 -67.92 0.24 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.55 178.379 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.3 tm0? -45.68 -42.8 12.03 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.016 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -61.89 -30.69 71.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.326 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.885 HG23 ' O ' ' A' ' 36' ' ' HIS . 61.8 t -64.39 -52.69 52.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.357 179.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.999 HD11 HD21 ' A' ' 12' ' ' LEU . 1.5 mp -42.77 -41.15 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.722 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 0.1 OUTLIER -72.77 -28.3 62.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.925 0.393 . . . . 0.0 110.429 179.775 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.519 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 1.1 m-20 -84.03 -28.87 27.35 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.899 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.767 ' CG1' HG12 ' A' ' 40' ' ' VAL . 18.2 mm -86.67 -39.01 12.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.972 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.706 ' CE1' HG23 ' A' ' 41' ' ' ILE . 11.6 m170 -77.94 -36.55 49.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.643 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.409 ' CB ' ' O ' ' A' ' 42' ' ' GLU . 9.8 t70 -76.62 -27.67 55.81 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.67 0.271 . . . . 0.0 110.533 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.519 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 4.1 m-85 -88.35 -43.4 11.54 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.908 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.56 ' HE1' ' HB3' ' A' ' 6' ' ' ASN . 25.5 ptt? -46.6 -29.57 1.88 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.807 0.337 . . . . 0.0 111.457 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -68.61 -28.11 66.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.105 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 141.21 -12.5 2.8 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.875 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -55.13 -22.63 29.61 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.716 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 155.21 55.0 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.281 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.478 ' OG ' HG22 ' A' ' 100' ' ' VAL . 1.2 t -76.17 -20.16 57.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.601 0.239 . . . . 0.0 111.39 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.8 74.03 2.11 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.542 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 145.6 -17.52 1.84 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.637 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.452 ' O ' ' CB ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.18 -43.08 11.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.673 0.273 . . . . 0.0 111.086 179.893 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.51 ' O ' ' CB ' ' A' ' 61' ' ' MET . 44.9 tp -64.34 -10.29 23.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.739 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -85.97 -49.75 7.6 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.853 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -87.14 -30.13 21.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.343 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.642 ' HG3' HG13 ' A' ' 40' ' ' VAL . 3.7 tpt -78.11 -31.39 49.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.861 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.51 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -56.16 -39.01 71.65 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.315 179.714 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.69 -11.57 60.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.144 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.4 ' OE1' ' CD2' ' A' ' 36' ' ' HIS . 3.3 tp10 -84.82 -26.25 27.57 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.46 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.478 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.4 p90 -87.19 -28.81 22.19 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.749 0.309 . . . . 0.0 110.92 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.38 -30.28 30.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.701 179.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -30.7 67.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.825 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 1.042 HG21 ' HB2' ' A' ' 37' ' ' LEU . 24.3 t -57.43 -59.87 2.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.566 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 1.071 HD11 HD13 ' A' ' 89' ' ' ILE . 1.7 mp -61.04 -13.7 18.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.369 178.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -66.82 -52.28 45.63 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.47 ' CG ' ' CZ3' ' A' ' 23' ' ' TRP . 0.2 OUTLIER -58.62 -33.63 70.25 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.76 0.79 . . . . 0.0 108.941 177.69 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.997 HD12 ' CB ' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -63.76 -65.91 0.62 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.265 -1.334 . . . . 0.0 111.851 -179.516 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.522 ' HA ' HD23 ' A' ' 75' ' ' LEU . 15.1 t30 -49.77 -23.91 2.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.708 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -85.24 -3.51 58.84 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 33.4 m-70 -150.92 36.49 0.62 Allowed 'General case' 0 CA--C 1.52 -0.188 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.854 HD21 HG22 ' A' ' 82' ' ' VAL . 0.5 OUTLIER -67.46 85.35 0.17 Allowed 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.343 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -68.03 65.75 0.1 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.97 -178.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.94 54.41 21.73 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.463 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.586 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -154.15 28.67 0.72 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.577 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.428 ' HE3' ' HG ' ' A' ' 75' ' ' LEU . 5.1 mmpt? -43.11 -27.35 0.21 Allowed 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 22.8 p80 -57.5 -41.22 80.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.162 0.506 . . . . 0.0 110.514 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.776 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.4 m -58.65 -52.35 66.06 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.156 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.951 HG13 ' CD2' ' A' ' 71' ' ' LEU . 0.2 OUTLIER -57.95 -60.05 2.67 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.529 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.55 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.47 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 60.8 t-80 -42.88 -40.02 2.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.877 0.37 . . . . 0.0 110.485 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -76.28 -49.05 18.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.177 179.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 1.066 HD11 HD13 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -75.34 -16.74 15.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.723 -179.231 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.618 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -93.08 -44.1 8.55 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 179.196 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 1.1 mp0 -62.69 -23.94 67.39 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 177.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.702 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.3 m-80 -82.73 -59.49 2.49 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 114.491 -1.231 . . . . 0.0 110.07 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 1.071 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -65.07 -49.68 78.24 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.35 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.453 -179.743 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.463 ' N ' HG22 ' A' ' 89' ' ' ILE . 1.3 tptp -58.47 -27.33 64.3 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.494 -0.482 . . . . 0.0 109.941 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -90.7 -4.69 56.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.25 178.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.702 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.0 OUTLIER -78.65 -48.02 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 179.525 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.627 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.2 OUTLIER -48.06 -28.21 2.72 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.456 179.16 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.627 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 34.0 t-80 -62.6 -63.51 1.2 Allowed 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.986 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.542 ' O ' HD21 ' A' ' 5' ' ' LEU . 22.8 m-70 -65.8 -9.17 26.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.182 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 19.3 mt -89.19 -59.87 2.1 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 120.982 0.42 . . . . 0.0 110.149 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.465 ' N ' HD21 ' A' ' 57' ' ' LEU . 87.2 mt-10 -69.0 -12.47 61.71 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.851 178.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -85.97 -22.51 27.32 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.625 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.875 HD13 HD23 ' A' ' 5' ' ' LEU . 27.8 tp -75.29 -60.47 2.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.896 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.478 HG22 ' OG ' ' A' ' 53' ' ' SER . 21.6 t -59.88 -41.09 84.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.389 -179.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.4 -30.56 70.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.919 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.824 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 CA-C-O 120.435 -0.092 . . . . 0.0 113.024 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.82 -19.78 61.26 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 116.758 0.279 . . . . 0.0 111.193 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 1.041 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -51.93 -23.34 4.85 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.177 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.491 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 16.5 t-20 -65.53 -36.26 83.29 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.766 179.001 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -48.5 -35.79 13.85 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.629 HD13 ' C ' ' A' ' 8' ' ' LEU . 2.4 tm? -88.25 -29.0 20.75 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.093 178.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.746 ' HG ' HD21 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -71.83 -27.01 62.62 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 120.825 0.345 . . . . 0.0 110.619 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -58.55 -46.23 87.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.269 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -46.59 -39.03 10.42 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.985 0.422 . . . . 0.0 111.201 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.978 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -58.53 -61.47 2.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.663 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.73 ' N ' HD23 ' A' ' 12' ' ' LEU . 1.8 tt0 -52.19 -34.9 47.45 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.791 -179.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.33 -29.7 53.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.889 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.865 HG11 ' ND2' ' A' ' 88' ' ' ASN . 0.4 OUTLIER -65.05 -34.52 71.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.834 179.104 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.796 ' CD1' HD13 ' A' ' 19' ' ' LEU . 3.8 mm? -57.13 -36.59 70.88 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.072 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.76 -45.08 4.66 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.127 0.489 . . . . 0.0 110.329 179.075 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.485 ' HB3' HG23 ' A' ' 81' ' ' THR . 59.3 m-80 -67.32 -44.42 79.19 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.324 178.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.879 HD12 HD22 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -52.82 -35.6 57.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.065 179.791 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.908 ' CE1' HD12 ' A' ' 30' ' ' LEU . 26.7 m-70 -55.18 -31.66 61.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.641 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.495 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 6.4 mmpt? -94.38 -4.59 48.18 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -178.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.598 ' HB2' HG21 ' A' ' 81' ' ' THR . 3.5 m-80 -128.06 -13.82 5.04 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.974 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.65 -38.47 84.96 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.573 -179.916 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.495 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 33.3 t60 -175.2 -48.66 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.861 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 143.28 126.6 2.04 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.409 -0.9 . . . . 0.0 112.819 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 88.02 100.13 0.92 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.316 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.38 -26.03 4.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.717 0.294 . . . . 0.0 110.566 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -55.63 -30.02 60.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.507 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -86.97 -35.19 19.0 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.436 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.974 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.2 tm? -71.86 -32.87 67.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.874 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -50.38 -36.24 31.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.846 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.72 -25.96 54.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.551 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.862 ' O ' HG22 ' A' ' 67' ' ' VAL . 2.8 p -89.8 -48.84 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.26 -179.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.57 ' HB2' HD11 ' A' ' 30' ' ' LEU . 2.3 t70 -69.08 -23.75 64.06 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -54.05 -36.14 62.76 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.769 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -62.85 -33.52 75.43 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.309 178.385 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.859 HD11 HD21 ' A' ' 12' ' ' LEU . 0.1 OUTLIER -74.51 -64.25 1.07 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.24 179.184 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.72 ' O ' HG22 ' A' ' 41' ' ' ILE . 3.3 tt0 -46.23 -31.54 2.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.39 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.43 -28.51 59.38 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.919 0.39 . . . . 0.0 110.376 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.769 HG23 ' O ' ' A' ' 36' ' ' HIS . 53.3 t -73.4 -46.42 49.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.659 179.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.72 HG22 ' O ' ' A' ' 38' ' ' GLN . 2.7 tp -45.47 -34.72 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.386 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.61 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 1.4 mt-10 -75.65 -30.95 59.62 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.646 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.528 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -82.8 -25.69 32.48 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.875 178.754 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.581 HG21 HD11 ' A' ' 9' ' ' LEU . 31.0 mm -87.29 -47.53 15.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.678 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.61 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -70.97 -26.9 63.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.865 -178.957 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.504 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 69.3 m-20 -86.65 -40.72 14.84 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.07 0.462 . . . . 0.0 110.302 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.528 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 4.3 m-85 -72.3 -40.94 67.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.216 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.473 ' HE3' ' HA ' ' A' ' 45' ' ' HIS . 16.7 ptp -53.29 -26.9 20.23 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.817 0.341 . . . . 0.0 111.072 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -79.71 -1.4 38.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.436 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 120.04 18.38 4.27 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.863 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.403 ' O ' ' CD2' ' A' ' 47' ' ' PHE . . . -95.97 28.1 13.99 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.453 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.27 38.98 3.86 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.448 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.1 p -62.45 -25.68 68.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.773 0.321 . . . . 0.0 111.182 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.42 70.92 3.01 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.531 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.413 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . 150.19 -20.86 1.09 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.798 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.478 ' O ' ' CB ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.44 -46.0 9.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.618 0.246 . . . . 0.0 111.473 -179.814 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.631 HD21 ' HB3' ' A' ' 96' ' ' LEU . 13.7 tp -62.6 -9.28 8.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 61' ' ' MET . 16.9 pt20 -86.2 -50.83 6.69 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.815 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 17.4 mm-40 -87.66 -28.31 21.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.951 0.405 . . . . 0.0 110.302 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.592 ' CG ' HG13 ' A' ' 40' ' ' VAL . 9.3 tpp -78.23 -33.15 50.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.042 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.554 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 3.8 ptt? -55.44 -38.99 69.73 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.547 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 66' ' ' GLN . 0.3 OUTLIER -65.62 -15.57 62.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.898 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.491 ' HB3' HG21 ' A' ' 40' ' ' VAL . 75.0 tt0 -79.32 -25.4 42.35 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.732 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.555 ' HA ' HD22 ' A' ' 37' ' ' LEU . 2.0 p90 -86.95 -35.39 18.91 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.903 0.382 . . . . 0.0 110.467 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.478 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 0.0 OUTLIER -74.47 -31.2 62.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.545 179.294 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 62' ' ' LYS . 11.6 tt0 -57.91 -33.99 69.35 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.505 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.862 HG22 ' O ' ' A' ' 33' ' ' VAL . 72.0 t -58.09 -47.09 87.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.079 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 1.022 HD11 HD13 ' A' ' 89' ' ' ILE . 1.3 mp -65.31 -14.68 61.33 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.269 178.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -66.37 -62.02 1.69 Allowed 'General case' 0 C--O 1.231 0.094 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HB3' HG21 ' A' ' 33' ' ' VAL . 14.4 tp10 -50.82 -32.1 19.1 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.787 0.804 . . . . 0.0 109.314 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.879 HD22 HD12 ' A' ' 19' ' ' LEU . 0.4 OUTLIER -74.52 -69.41 0.46 Allowed 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 113.979 -1.464 . . . . 0.0 112.232 -178.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.411 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 1.5 t-20 -49.49 -26.3 3.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.702 -179.203 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.64 6.26 28.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.557 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.593 ' O ' ' N ' ' A' ' 76' ' ' GLN . 66.6 m-70 -152.15 32.71 0.53 Allowed 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.746 HD21 HG21 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -54.65 83.28 0.0 OUTLIER 'General case' 0 CA--C 1.521 -0.135 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.789 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.593 ' N ' ' O ' ' A' ' 74' ' ' HIS . 1.0 OUTLIER -83.9 -34.07 24.62 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.947 -177.425 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -83.85 -66.45 1.49 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.615 -0.802 . . . . 0.0 113.062 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -174.35 116.88 0.6 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.115 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.57 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -44.28 -29.78 0.71 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.634 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -45.58 -30.81 1.6 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.838 0.352 . . . . 0.0 111.032 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.598 HG21 ' HB2' ' A' ' 22' ' ' ASN . 1.2 m -69.93 -74.4 0.14 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.851 HG13 HD21 ' A' ' 71' ' ' LEU . 22.2 t -48.92 -40.88 12.8 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.384 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.034 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.471 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -48.97 -41.31 33.78 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.089 0.471 . . . . 0.0 109.737 179.541 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.433 ' O ' ' HB3' ' A' ' 88' ' ' ASN . 0.6 OUTLIER -76.25 -27.58 56.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.696 178.865 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.997 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.61 -36.16 10.48 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.165 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.151 -179.611 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.471 ' CG ' ' HA ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -71.93 -43.68 64.88 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.213 -0.292 . . . . 0.0 110.213 179.433 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -62.41 -29.46 70.51 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.865 ' ND2' HG11 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -82.92 -57.3 3.35 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.305 179.122 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 1.022 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -61.56 -48.23 89.73 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.374 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.97 -179.616 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.454 ' N ' HG22 ' A' ' 89' ' ' ILE . 20.6 tptp -61.46 -28.57 69.38 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 120.291 -0.564 . . . . 0.0 109.494 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -90.73 -2.24 57.82 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.094 178.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.7 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.0 OUTLIER -78.62 -43.27 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.355 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.637 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -54.97 -26.64 37.98 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.149 178.692 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.637 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.1 OUTLIER -62.87 -65.73 0.64 Allowed 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.84 -179.523 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.576 ' HB3' HD11 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -60.15 -12.1 7.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.108 178.378 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.746 HD21 ' HG ' ' A' ' 9' ' ' LEU . 55.5 mt -89.29 -65.7 0.99 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.529 179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.466 ' HA ' HD23 ' A' ' 57' ' ' LEU . 4.2 mm-40 -63.09 -16.36 59.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.17 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 94' ' ' HIS . 56.6 tt0 -87.83 -10.73 49.95 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.745 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 1.041 HD13 HD23 ' A' ' 5' ' ' LEU . 30.0 tp -81.4 -57.18 3.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.644 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 41.1 t -62.35 -31.13 50.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.276 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -69.4 -40.61 77.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.919 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.293 -0.861 . . . . 0.0 110.921 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 N-CA-C 112.488 -0.245 . . . . 0.0 112.488 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 tptm -59.96 -17.44 38.09 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 116.611 0.205 . . . . 0.0 110.928 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.744 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -49.27 -25.56 2.43 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.111 -0.699 . . . . 0.0 109.111 178.041 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -59.29 -41.2 88.39 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.832 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -50.42 -31.45 15.04 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.204 0.526 . . . . 0.0 110.001 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.669 ' O ' HD13 ' A' ' 8' ' ' LEU . 2.8 tm? -83.49 -30.61 27.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.024 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.668 ' HB3' HD11 ' A' ' 41' ' ' ILE . 8.8 mt -60.79 -42.78 98.25 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.555 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -45.5 -40.05 8.05 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.487 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.421 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 5.4 m-20 -54.65 -43.02 72.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.987 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.972 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -56.57 -63.36 1.22 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.534 179.805 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.775 ' HA ' HD23 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -52.41 -37.77 57.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.314 -179.14 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -75.18 -26.73 59.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.941 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.892 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -68.89 -28.52 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.09 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 1.015 HD12 HD13 ' A' ' 19' ' ' LEU . 1.6 mm? -67.48 -34.63 77.55 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.312 179.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 ttpp -40.45 -33.94 0.3 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.151 0.501 . . . . 0.0 110.515 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.888 ' HB3' HG23 ' A' ' 81' ' ' THR . 2.2 m-20 -81.18 -41.53 22.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.905 178.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 1.015 HD13 HD12 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -51.72 -29.93 20.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.128 179.722 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.972 ' CE1' HD12 ' A' ' 30' ' ' LEU . 76.2 m-70 -62.19 -37.51 85.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.021 0.439 . . . . 0.0 110.836 -179.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.545 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 4.3 mmpt? -94.5 16.85 14.29 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.034 -178.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.497 ' HB2' HG21 ' A' ' 81' ' ' THR . 7.6 m-80 -145.41 -20.12 0.48 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -179.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.967 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -63.75 -27.66 69.35 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 119.719 -0.793 . . . . 0.0 110.959 -179.608 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.46 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 86.2 t60 -178.86 -53.13 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.889 0.376 . . . . 0.0 110.643 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 141.68 126.83 2.2 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.874 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 90.9 94.63 1.26 Allowed Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.107 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.82 -26.65 1.72 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.753 0.311 . . . . 0.0 110.591 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -53.8 -32.25 51.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.484 179.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -86.25 -42.37 13.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.329 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.972 HD12 ' CE1' ' A' ' 20' ' ' HIS . 1.5 tm? -62.05 -35.89 79.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.838 179.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.468 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 45.3 t60 -46.61 -35.35 5.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.404 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.61 -24.1 53.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.689 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.892 ' O ' HG22 ' A' ' 67' ' ' VAL . 2.7 p -91.87 -47.17 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.438 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.662 ' HB2' HD11 ' A' ' 30' ' ' LEU . 6.7 t70 -71.63 -23.98 61.79 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.086 179.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.468 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 11.3 t30 -54.33 -30.69 52.18 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.741 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -69.0 -32.21 71.6 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.851 178.569 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.821 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -75.39 -64.52 1.05 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.434 179.427 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.747 ' O ' HG22 ' A' ' 41' ' ' ILE . 1.5 pt20 -47.08 -28.53 1.76 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.298 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -76.33 -28.36 56.87 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.91 0.386 . . . . 0.0 110.351 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.741 HG23 ' O ' ' A' ' 36' ' ' HIS . 78.6 t -75.92 -43.3 39.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.504 179.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.747 HG22 ' O ' ' A' ' 38' ' ' GLN . 4.7 tp -46.5 -33.11 1.84 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.13 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.056 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.562 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 1.6 mt-10 -75.57 -30.59 59.72 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.081 179.093 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.597 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 43.2 m-20 -82.79 -25.41 32.76 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.835 178.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.789 HD13 ' HE2' ' A' ' 56' ' ' LYS . 17.1 mm -86.9 -53.05 10.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.098 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.562 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -64.58 -27.71 69.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.23 -179.657 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.511 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 25.9 t0 -86.63 -46.8 9.75 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 120.907 0.384 . . . . 0.0 110.501 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.597 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.5 m-30 -66.5 -23.24 66.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.567 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.407 ' HE3' HD22 ' A' ' 96' ' ' LEU . 0.0 OUTLIER -52.8 -26.01 13.11 Favored 'General case' 0 C--N 1.334 -0.109 0 CA-C-O 120.888 0.375 . . . . 0.0 110.635 179.427 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -90.9 9.45 30.36 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.367 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.58 -2.15 58.75 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.694 -0.765 . . . . 0.0 113.082 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.36 -41.28 31.84 Favored Glycine 0 C--N 1.333 0.39 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.167 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.442 ' HA3' ' CE2' ' A' ' 47' ' ' PHE . . . -163.74 24.73 0.19 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.178 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.59 -168.32 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.883 0.373 . . . . 0.0 110.764 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.651 ' H ' HG11 ' A' ' 100' ' ' VAL . . . 88.65 -62.02 3.76 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.77 -0.728 . . . . 0.0 113.041 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.434 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . -124.57 11.55 7.96 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.386 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.789 ' HE2' HD13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -88.43 -44.23 10.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 117.034 0.417 . . . . 0.0 111.249 179.858 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.72 HD22 ' NZ ' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -59.32 -14.09 10.32 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.872 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 55' ' ' GLY . 27.1 pt20 -85.9 -50.62 6.96 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.34 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -85.87 -29.81 23.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.864 0.364 . . . . 0.0 110.655 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.645 ' HG2' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -78.3 -31.78 49.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.995 179.796 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.517 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 0.1 OUTLIER -56.86 -40.47 76.21 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.489 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.97 -19.44 61.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.929 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.536 ' HB3' HG21 ' A' ' 40' ' ' VAL . 18.7 tt0 -76.46 -31.86 58.06 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.543 -179.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.577 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.1 p90 -87.04 -25.86 24.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.88 0.371 . . . . 0.0 110.456 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -82.13 -30.96 30.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.417 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -58.48 -36.7 74.14 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.416 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.892 HG22 ' O ' ' A' ' 33' ' ' VAL . 83.4 t -54.19 -42.89 58.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.422 179.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 1.096 HD21 HG13 ' A' ' 85' ' ' ILE . 0.5 OUTLIER -74.09 -14.28 60.96 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.512 179.142 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.67 -52.19 53.53 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.417 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 5.5 tp10 -57.65 -24.57 57.26 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.528 0.68 . . . . 0.0 109.709 178.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 1.019 HD23 HG22 ' A' ' 82' ' ' VAL . 0.9 OUTLIER -70.45 -65.27 0.75 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.734 -1.121 . . . . 0.0 112.818 -178.826 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -46.53 -21.7 0.21 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.418 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.407 ' N ' ' C ' ' A' ' 71' ' ' LEU . 45.7 m-20 -83.56 -23.85 31.84 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.135 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.53 ' CB ' ' O ' ' A' ' 23' ' ' TRP . 44.1 m-70 -135.94 33.2 2.91 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 119.234 -0.986 . . . . 0.0 112.993 -179.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.64 ' CD2' HG21 ' A' ' 82' ' ' VAL . 0.0 OUTLIER -51.92 92.08 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 177.587 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.484 ' N ' ' O ' ' A' ' 74' ' ' HIS . 41.9 tp60 -64.3 69.14 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.55 -178.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 52.74 25.49 22.4 Favored Glycine 0 N--CA 1.453 -0.176 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.716 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -126.7 40.01 1.87 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.426 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.439 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -48.9 -31.47 7.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.638 0.256 . . . . 0.0 111.215 -179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -58.25 -31.72 67.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.042 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.888 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -68.02 -74.56 0.12 Allowed 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 1.019 HG22 HD23 ' A' ' 71' ' ' LEU . 12.6 t -49.09 -40.93 13.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.95 179.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.48 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 7.0 m170 -49.33 -41.86 39.86 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.189 0.519 . . . . 0.0 109.776 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -76.27 -27.07 56.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.622 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 1.096 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.25 -36.34 10.94 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.9 -179.865 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -71.11 -45.82 62.89 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.164 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.04 -29.74 67.52 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.732 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.8 m-80 -82.96 -67.61 0.77 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.505 179.147 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.972 ' CG1' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -52.84 -47.83 51.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.511 -179.591 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.427 ' N ' HG22 ' A' ' 89' ' ' ILE . 0.1 OUTLIER -62.3 -29.26 70.31 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.28 -0.568 . . . . 0.0 109.662 179.647 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -90.78 -4.0 56.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.168 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.732 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -78.58 -44.59 25.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.628 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -52.39 -29.19 22.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.536 179.149 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.628 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 38.1 t-80 -61.57 -65.36 0.7 Allowed 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.109 -179.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.433 ' HB3' HD11 ' A' ' 5' ' ' LEU . 40.9 m170 -62.44 -9.56 8.82 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.369 178.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.503 HD11 HD21 ' A' ' 9' ' ' LEU . 30.9 mt -89.3 -63.46 1.29 Allowed 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 120.956 0.408 . . . . 0.0 110.456 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -67.56 -12.25 59.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.219 179.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 94' ' ' HIS . 11.2 mm-40 -87.92 -26.42 22.72 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 120.912 0.386 . . . . 0.0 110.377 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.744 HD13 HD23 ' A' ' 5' ' ' LEU . 11.3 tp -66.83 -56.84 8.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.92 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.651 HG11 ' H ' ' A' ' 54' ' ' GLY . 31.9 t -63.56 -39.94 87.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.423 -179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -60.9 -33.04 72.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.837 0.351 . . . . 0.0 111.006 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.838 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 112.84 -0.104 . . . . 0.0 112.84 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -63.2 -17.63 62.62 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.61 0.205 . . . . 0.0 111.105 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.803 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -51.17 -24.02 3.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.046 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.412 ' N ' ' CE ' ' A' ' 48' ' ' MET . 33.6 p-10 -59.61 -41.13 89.66 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.896 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -48.24 -32.59 7.4 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.22 0.533 . . . . 0.0 110.048 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.618 ' C ' HD13 ' A' ' 8' ' ' LEU . 2.5 tm? -87.4 -30.3 20.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.295 179.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.835 ' HG ' HD21 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -68.92 -34.94 76.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.359 179.799 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -52.96 -43.06 66.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.302 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.41 -41.31 28.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.927 0.394 . . . . 0.0 111.001 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.007 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -57.36 -61.22 2.63 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.6 179.833 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.724 ' H ' HD23 ' A' ' 12' ' ' LEU . 7.5 tm0? -51.28 -38.04 50.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.047 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -75.67 -28.47 58.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.905 179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.818 HG13 ' HB ' ' A' ' 85' ' ' ILE . 0.3 OUTLIER -68.18 -31.08 50.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.983 179.19 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.759 ' CD1' HD13 ' A' ' 19' ' ' LEU . 3.4 mm? -60.5 -37.38 80.92 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.207 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.2 ttpt -41.78 -41.91 2.48 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.033 0.444 . . . . 0.0 110.554 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.752 ' HB3' HG23 ' A' ' 81' ' ' THR . 0.8 OUTLIER -70.9 -43.77 67.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.759 178.729 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.887 HD12 HD22 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -50.42 -44.0 55.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.572 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 1.058 ' CE1' HD12 ' A' ' 30' ' ' LEU . 78.5 m-70 -49.33 -31.3 8.96 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.502 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 6.2 mmpt? -94.24 -9.86 34.79 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -177.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.634 ' HB2' HG21 ' A' ' 81' ' ' THR . 4.8 m120 -126.37 3.82 6.99 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -179.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.779 ' CB ' HD12 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -77.06 -54.05 7.03 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.752 179.833 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.524 ' HB3' ' CZ2' ' A' ' 23' ' ' TRP . 8.7 t-160 179.39 57.6 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.921 0.391 . . . . 0.0 111.027 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 118.21 -107.5 1.48 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.302 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -124.65 -146.2 6.81 Favored Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.167 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.454 ' CD ' ' CE1' ' A' ' 20' ' ' HIS . 17.3 ttpp -94.11 -11.13 31.18 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -50.41 -65.45 0.56 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -178.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -75.14 -25.39 58.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.567 0.222 . . . . 0.0 111.111 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.058 HD12 ' CE1' ' A' ' 20' ' ' HIS . 2.0 tm? -72.99 -29.15 62.82 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.432 ' N ' ' O ' ' A' ' 27' ' ' LYS . 28.3 t60 -47.71 -51.85 20.51 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.527 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.11 -22.48 66.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.887 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.955 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.2 t -85.82 -62.25 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.864 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.591 ' H ' HD13 ' A' ' 30' ' ' LEU . 1.3 t0 -59.42 -25.26 64.18 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -56.41 -39.42 72.99 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 177.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.736 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -65.13 -45.85 83.39 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 177.444 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.965 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -53.51 -69.69 0.11 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.619 178.623 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.855 ' O ' HG22 ' A' ' 41' ' ' ILE . 1.6 mt-30 -46.48 -43.55 16.79 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.038 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -54.99 -26.22 35.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.05 0.452 . . . . 0.0 110.243 179.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.736 HG23 ' O ' ' A' ' 36' ' ' HIS . 32.5 t -74.36 -57.52 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.374 179.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.855 HG22 ' O ' ' A' ' 38' ' ' GLN . 0.5 OUTLIER -44.49 -35.71 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.79 -179.766 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.628 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 3.8 pt-20 -75.64 -30.29 59.41 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.829 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.517 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 2.1 m-20 -84.08 -27.56 28.17 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.885 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.584 HG22 ' SD ' ' A' ' 48' ' ' MET . 25.3 mm -86.99 -48.43 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.497 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.628 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -68.96 -26.83 65.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.276 -179.631 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.524 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 14.0 t70 -86.48 -41.91 14.0 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.071 0.463 . . . . 0.0 110.226 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.517 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.4 m-85 -72.14 -23.72 61.34 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.606 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.584 ' SD ' HG22 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -54.01 -34.6 60.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.981 179.752 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -73.77 -22.46 59.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.422 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 146.14 -11.8 1.61 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.428 -0.892 . . . . 0.0 113.082 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.36 -26.44 4.97 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.71 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 154.03 44.61 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.256 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.661 ' OG ' HG22 ' A' ' 100' ' ' VAL . 1.8 t -59.53 -29.65 68.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.731 0.3 . . . . 0.0 111.03 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.23 72.03 2.05 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.191 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.464 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . 149.03 -19.79 1.23 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.575 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.492 ' CD ' HD13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -88.64 -46.01 9.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.663 0.268 . . . . 0.0 111.279 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.795 HD11 ' HB3' ' A' ' 96' ' ' LEU . 5.7 tp -61.79 -10.84 9.95 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.464 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 1.6 pp0? -85.88 -50.98 6.69 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.939 179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -86.88 -30.8 21.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.997 0.427 . . . . 0.0 110.382 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.729 ' HG3' HG13 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -76.39 -29.52 57.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.616 179.637 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.508 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 2.9 tmm? -55.66 -44.69 77.47 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 121.015 0.436 . . . . 0.0 110.509 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -12.82 60.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.181 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.42 ' HB3' HG22 ' A' ' 40' ' ' VAL . 28.2 tt0 -83.2 -24.75 32.28 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.535 -179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.491 ' HB3' HG11 ' A' ' 40' ' ' VAL . 1.6 p90 -87.08 -35.38 18.74 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.902 0.382 . . . . 0.0 110.427 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.458 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 0.0 OUTLIER -79.17 -30.97 43.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.96 179.757 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -58.92 -34.93 72.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.019 0.438 . . . . 0.0 110.407 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.965 HG21 ' HB2' ' A' ' 37' ' ' LEU . 80.5 t -57.65 -44.05 84.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.418 179.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 1.033 HD11 HD13 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.44 -9.21 55.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.611 178.799 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -71.45 -57.99 3.92 Favored 'General case' 0 C--O 1.231 0.098 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.589 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 3.5 tp10 -53.38 -37.48 62.47 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.949 0.88 . . . . 0.0 108.996 177.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.887 HD22 HD12 ' A' ' 19' ' ' LEU . 0.3 OUTLIER -70.86 -68.34 0.44 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.72 -1.582 . . . . 0.0 112.04 -179.32 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.411 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 22.5 t30 -49.3 -25.59 2.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.924 -179.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -85.28 4.17 36.15 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.656 ' O ' ' N ' ' A' ' 76' ' ' GLN . 72.2 m-70 -150.9 32.03 0.62 Allowed 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.597 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -50.27 82.76 0.0 OUTLIER 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.912 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.656 ' N ' ' O ' ' A' ' 74' ' ' HIS . 4.5 tt0 -84.18 -34.32 24.0 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.675 -177.512 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -88.1 -20.34 49.91 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.7 -0.762 . . . . 0.0 113.009 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.512 ' C ' HD12 ' A' ' 75' ' ' LEU . . . 130.82 130.24 3.16 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.256 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.597 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -52.76 -19.44 2.45 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -179.824 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -48.6 -39.24 23.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.696 0.284 . . . . 0.0 111.32 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.752 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -69.55 -74.15 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 178.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.872 HG13 HD21 ' A' ' 71' ' ' LEU . 25.8 t -47.77 -36.8 5.5 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.414 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.084 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.474 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 57.0 t-80 -52.45 -41.08 62.97 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -76.17 -28.26 57.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.459 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.987 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.61 -33.15 7.45 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.196 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.054 -179.728 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.575 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -75.95 -44.69 38.74 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.059 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -60.85 -29.97 69.84 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.716 ' O ' HD13 ' A' ' 92' ' ' ILE . 2.0 m-80 -82.89 -63.19 1.41 Allowed 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.065 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 1.033 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -54.5 -48.51 69.79 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.186 179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.45 ' N ' HG22 ' A' ' 89' ' ' ILE . 0.1 OUTLIER -60.88 -29.55 69.62 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.6 179.658 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -90.8 -3.44 57.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.371 178.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.716 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -78.65 -39.05 22.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.62 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -60.45 -25.07 65.72 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.25 178.689 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.62 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 8.9 t-80 -60.56 -65.91 0.61 Allowed 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.222 -179.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.601 ' HB3' HD11 ' A' ' 5' ' ' LEU . 63.7 m80 -63.67 -9.32 13.36 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.48 178.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.835 HD21 ' HG ' ' A' ' 9' ' ' LEU . 55.2 mt -89.48 -59.7 2.14 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.127 0.489 . . . . 0.0 110.543 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.422 ' HA ' ' CD2' ' A' ' 57' ' ' LEU . 5.4 mt-10 -66.61 -11.96 55.83 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.382 179.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.533 ' HB2' ' O ' ' A' ' 94' ' ' HIS . 8.8 tt0 -94.68 3.71 54.73 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.723 0.297 . . . . 0.0 111.111 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.803 HD13 HD23 ' A' ' 5' ' ' LEU . 8.1 tp -101.66 -47.48 4.62 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.966 0.412 . . . . 0.0 110.669 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.661 HG22 ' OG ' ' A' ' 53' ' ' SER . 41.2 t -76.89 -34.12 22.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.124 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -98.33 31.33 2.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.943 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.6 tpt85 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.958 179.98 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.518 ' HA2' ' HG3' ' A' ' 48' ' ' MET . . . . . . . . 0 N--CA 1.451 -0.301 0 CA-C-O 120.397 -0.113 . . . . 0.0 112.99 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.45 -18.62 61.68 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 116.654 0.227 . . . . 0.0 111.056 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.891 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -53.14 -21.76 5.42 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.061 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.595 ' HA ' HD12 ' A' ' 9' ' ' LEU . 38.5 p-10 -61.39 -40.18 93.4 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.815 179.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -51.38 -28.44 12.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.086 0.469 . . . . 0.0 110.012 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.814 ' O ' HD22 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -83.86 -29.38 27.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.002 179.22 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.813 ' O ' HD23 ' A' ' 12' ' ' LEU . 10.3 mt -63.79 -30.61 71.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.049 0.452 . . . . 0.0 110.792 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -54.46 -51.28 65.52 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.549 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -51.25 -49.55 60.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.885 0.374 . . . . 0.0 111.33 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.044 HD21 HD11 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -56.51 -60.82 2.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.615 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.615 ' HA ' HD23 ' A' ' 16' ' ' LEU . 2.4 tt0 -53.85 -35.28 61.31 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.037 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -77.98 -26.03 48.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.228 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.848 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -70.5 -27.56 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.401 179.314 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.676 HD12 HD22 ' A' ' 19' ' ' LEU . 3.0 mm? -61.1 -36.66 80.28 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.313 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.562 ' HA ' ' CD2' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -48.68 -40.54 28.52 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.105 0.479 . . . . 0.0 110.096 179.478 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.92 -39.17 76.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.515 178.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.909 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -55.74 -53.53 55.45 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.842 -179.662 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.59 ' CA ' ' HG ' ' A' ' 30' ' ' LEU . 2.2 p80 -53.93 -15.44 1.37 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -178.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.626 ' HA ' ' CE ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -92.85 -24.12 18.59 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.674 -179.815 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.552 ' HB2' HG21 ' A' ' 81' ' ' THR . 3.4 m-80 -130.8 28.71 4.82 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.832 0.349 . . . . 0.0 111.061 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.901 ' CB ' HD12 ' A' ' 71' ' ' LEU . 2.4 p-90 -88.99 -31.84 17.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.739 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.506 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 79.7 t60 -177.9 -52.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.652 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 168.04 120.19 0.51 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.568 -0.825 . . . . 0.0 113.105 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 61.97 128.51 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.838 179.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.439 ' HD2' ' CD2' ' A' ' 20' ' ' HIS . 7.6 tttt -64.11 -16.26 61.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.597 0.237 . . . . 0.0 110.917 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -44.94 -48.98 11.34 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.483 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -77.44 -39.45 46.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.482 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.809 ' O ' HD13 ' A' ' 30' ' ' LEU . 1.8 tm? -59.81 -28.2 67.25 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.425 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 1.4 t60 -46.39 -58.73 3.47 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.306 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.43 -21.88 60.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.746 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.863 ' CG1' HG13 ' A' ' 67' ' ' VAL . 2.2 t -83.41 -65.26 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.846 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.635 ' H ' HD13 ' A' ' 30' ' ' LEU . 1.3 t0 -61.37 -25.03 66.89 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.369 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.425 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 16.2 t-20 -58.77 -41.15 85.92 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 177.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.734 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -64.72 -46.95 80.09 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 177.171 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.97 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -51.44 -68.48 0.17 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.945 178.521 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.404 ' HG3' ' N ' ' A' ' 39' ' ' ASN . 9.0 pt20 -46.66 -41.77 15.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.133 -179.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.404 ' N ' ' HG3' ' A' ' 38' ' ' GLN . 1.5 t-20 -59.25 -26.54 64.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.24 179.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.772 HG12 ' CD1' ' A' ' 44' ' ' ILE . 14.9 t -70.92 -52.89 24.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.404 179.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 1.044 HD11 HD21 ' A' ' 12' ' ' LEU . 1.8 mp -46.07 -38.64 3.13 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.535 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.612 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 1.5 pt-20 -72.91 -28.74 62.65 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 120.747 0.308 . . . . 0.0 110.802 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.555 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 6.0 m-20 -84.14 -28.31 27.53 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.772 ' CD1' HG12 ' A' ' 40' ' ' VAL . 34.3 mt -86.56 -52.48 11.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.335 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.612 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -63.27 -26.76 68.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.727 -179.943 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.513 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 13.5 t70 -86.68 -36.68 18.59 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.026 0.441 . . . . 0.0 110.01 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.555 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.2 m-85 -74.22 -42.1 60.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.28 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.518 ' HG3' ' HA2' ' A' ' 3' ' ' GLY . 12.1 ptp -51.73 -24.09 5.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.331 -179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -88.71 9.29 24.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.516 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 111.27 20.36 7.1 Favored Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.991 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.407 ' CA ' ' HA ' ' A' ' 47' ' ' PHE . . . -96.45 26.95 19.3 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.706 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.87 29.82 7.08 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.608 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.641 ' O ' HG11 ' A' ' 100' ' ' VAL . 0.2 OUTLIER -66.31 -12.92 59.37 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.514 0.19 . . . . 0.0 111.514 -179.9 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.455 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -83.16 71.63 2.98 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.668 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.414 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . 131.1 -9.45 5.68 Favored Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.803 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.497 ' HE3' ' CG ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -88.51 -34.38 17.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.668 0.27 . . . . 0.0 111.295 -179.749 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.594 HD21 HG23 ' A' ' 44' ' ' ILE . 0.1 OUTLIER -65.51 -11.58 44.77 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -179.197 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.414 ' HG2' ' O ' ' A' ' 55' ' ' GLY . 15.1 pt20 -86.47 -50.03 7.17 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.547 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 71.4 mt-10 -85.54 -31.02 22.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.835 0.35 . . . . 0.0 110.783 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.661 ' HG3' HG13 ' A' ' 40' ' ' VAL . 0.8 OUTLIER -78.11 -33.09 50.75 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.902 179.768 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.511 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 4.5 tmm? -55.37 -39.17 69.77 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.562 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.84 -17.27 62.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.967 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.95 -31.36 45.05 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.559 ' HA ' HD22 ' A' ' 37' ' ' LEU . 0.8 OUTLIER -87.27 -24.49 24.34 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.192 0.52 . . . . 0.0 109.597 179.351 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -83.02 -33.39 26.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.164 178.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -55.48 -38.44 69.12 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.904 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.97 HG21 ' HB2' ' A' ' 37' ' ' LEU . 3.9 t -51.57 -44.39 33.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.109 0.48 . . . . 0.0 110.285 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.884 HD21 HG13 ' A' ' 85' ' ' ILE . 0.9 OUTLIER -68.4 -6.71 26.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.003 179.302 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -75.85 -59.89 2.56 Favored 'General case' 0 C--N 1.338 0.092 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.468 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -48.44 -40.7 27.04 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 122.391 1.091 . . . . 0.0 108.564 177.447 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.909 HD13 ' CG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -70.74 -68.12 0.45 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 112.904 -1.953 . . . . 0.0 112.029 -179.421 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -51.15 -26.08 6.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.346 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -87.91 9.21 22.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.265 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.491 ' O ' ' N ' ' A' ' 76' ' ' GLN . 14.2 m-70 -158.68 35.63 0.22 Allowed 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.633 HD11 HG23 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -54.67 88.44 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.198 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 74' ' ' HIS . 3.6 tp60 -63.76 69.25 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.384 -178.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 57.11 30.68 61.0 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.401 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.428 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -130.62 39.12 1.84 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.587 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.462 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -49.47 -32.03 11.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.697 0.284 . . . . 0.0 111.26 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -63.18 -31.53 72.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.135 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.552 HG21 ' HB2' ' A' ' 22' ' ' ASN . 1.9 m -67.49 -72.57 0.16 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.908 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.808 ' CG1' HD21 ' A' ' 71' ' ' LEU . 42.9 t -51.48 -39.1 21.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.852 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.48 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.3 OUTLIER -46.6 -41.23 14.21 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 179.226 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -76.27 -29.73 57.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.729 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.884 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.38 -30.44 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.106 -179.675 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.3 OUTLIER -79.76 -46.51 16.86 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.929 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.428 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 1.7 mp0 -59.59 -27.51 66.34 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 177.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.529 ' O ' HD12 ' A' ' 92' ' ' ILE . 1.6 m-80 -82.71 -69.17 0.65 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.811 178.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.949 ' CG1' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -49.84 -39.39 15.01 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.445 -179.964 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.504 ' O ' ' CD2' ' A' ' 93' ' ' PHE . 28.5 mmmt -63.54 -23.55 67.43 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 119.89 -0.724 . . . . 0.0 110.002 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -90.54 -8.75 49.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.177 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.835 HD13 ' HA ' ' A' ' 89' ' ' ILE . 1.2 mp -78.75 -56.31 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.977 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.504 ' CD2' ' O ' ' A' ' 90' ' ' LYS . 0.6 OUTLIER -45.72 -44.56 13.75 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.726 179.669 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.485 ' N ' ' CG ' ' A' ' 93' ' ' PHE . 9.3 t-160 -57.52 -61.43 2.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.789 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -61.54 -11.97 13.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.502 178.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 18.7 mt -89.18 -65.55 1.01 Allowed 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.972 0.415 . . . . 0.0 110.599 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -65.71 -13.31 59.03 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.114 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.478 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 4.4 tp10 -87.07 -26.94 23.44 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-O 120.938 0.399 . . . . 0.0 110.306 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.891 HD13 HD23 ' A' ' 5' ' ' LEU . 18.8 tp -66.19 -57.74 6.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.634 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.641 HG11 ' O ' ' A' ' 53' ' ' SER . 33.5 t -64.15 -37.66 80.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.21 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -60.91 -43.15 98.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.896 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.852 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.571 ' HA2' ' HG3' ' A' ' 48' ' ' MET . . . . . . . . 0 N--CA 1.452 -0.298 0 N-CA-C 112.726 -0.15 . . . . 0.0 112.726 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.4 tptm -63.85 -17.43 63.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.481 0.181 . . . . 0.0 111.044 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.927 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -52.38 -22.9 5.12 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.198 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.459 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 26.3 p-10 -56.95 -46.38 82.16 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.02 179.266 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -49.43 -32.16 11.2 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.089 0.471 . . . . 0.0 110.209 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.608 ' C ' HD13 ' A' ' 8' ' ' LEU . 1.7 tm? -87.85 -26.65 22.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.384 179.246 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.826 HD22 HD12 ' A' ' 41' ' ' ILE . 1.0 OUTLIER -74.41 -40.94 61.68 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.748 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -49.3 -42.05 40.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.638 -179.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -50.41 -42.32 53.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.129 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.976 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -59.57 -62.53 1.81 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.678 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.731 ' H ' HD23 ' A' ' 12' ' ' LEU . 4.0 tt0 -51.17 -35.45 36.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.977 -179.339 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -77.39 -30.92 53.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.953 179.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.892 HG11 ' ND2' ' A' ' 88' ' ' ASN . 0.4 OUTLIER -63.68 -32.48 57.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.831 179.033 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.811 ' CD1' HD13 ' A' ' 19' ' ' LEU . 3.6 mm? -59.45 -36.52 76.1 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.396 179.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.9 ttpt -43.02 -42.55 3.89 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.038 0.447 . . . . 0.0 110.291 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.68 ' HB3' HG23 ' A' ' 81' ' ' THR . 0.3 OUTLIER -70.35 -44.96 67.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.7 178.673 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.916 HD12 HD22 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -48.03 -41.49 25.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.421 -179.969 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 1.048 ' CE1' HD12 ' A' ' 30' ' ' LEU . 50.0 m-70 -51.69 -35.01 41.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.927 -179.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.53 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.0 mmpt? -92.34 1.81 57.01 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -177.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.5 ' O ' HD13 ' A' ' 75' ' ' LEU . 2.1 m-80 -142.1 10.64 1.95 Allowed 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.385 -0.526 . . . . 0.0 112.323 -179.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.794 ' CA ' HD12 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -81.53 -36.88 28.64 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.809 179.734 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.503 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 86.3 t60 -179.99 -52.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.877 0.37 . . . . 0.0 110.672 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 154.71 149.72 5.34 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.536 -0.84 . . . . 0.0 113.046 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.13 103.66 0.01 OUTLIER Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.555 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -54.14 -23.01 12.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.756 0.313 . . . . 0.0 110.696 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.73 -32.97 21.15 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.858 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -85.27 -47.57 9.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.453 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.048 HD12 ' CE1' ' A' ' 20' ' ' HIS . 2.2 tm? -59.53 -29.69 68.07 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.418 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.4 OUTLIER -45.75 -56.45 5.29 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.685 179.738 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.92 -20.24 63.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.932 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.956 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.3 t -87.34 -62.75 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.762 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.602 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -60.99 -24.91 66.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.93 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 1.5 t30 -58.64 -39.87 81.76 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 177.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.955 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.2 OUTLIER -61.68 -51.47 68.29 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.588 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.004 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -53.94 -68.12 0.21 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.965 178.651 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.772 ' O ' HG22 ' A' ' 41' ' ' ILE . 14.6 tm0? -46.81 -40.08 13.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.741 -179.239 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -69.01 -22.96 64.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.965 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.955 HG23 ' O ' ' A' ' 36' ' ' HIS . 66.5 t -78.33 -38.83 23.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.485 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.826 HD12 HD22 ' A' ' 9' ' ' LEU . 1.1 tp -48.1 -34.64 4.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.412 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -75.69 -37.33 59.62 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 120.967 0.413 . . . . 0.0 109.902 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.515 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -62.47 -30.59 71.36 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.637 178.768 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.552 HG23 HD13 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -86.85 -35.26 8.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.581 179.128 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.414 ' NE2' HG13 ' A' ' 41' ' ' ILE . 23.5 m170 -70.19 -42.12 72.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.738 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.25 -21.76 53.23 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.998 178.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.515 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.3 m-85 -88.64 -45.25 10.0 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.985 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.571 ' HG3' ' HA2' ' A' ' 3' ' ' GLY . 14.6 ptt? -49.79 -24.76 2.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.723 0.297 . . . . 0.0 111.488 -179.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 mm100 -90.61 15.29 11.23 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.534 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 102.54 26.13 7.39 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.867 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.41 ' CA ' ' HA ' ' A' ' 47' ' ' PHE . . . -104.07 31.51 8.58 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.649 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.35 23.94 7.76 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.769 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.522 ' O ' HG21 ' A' ' 100' ' ' VAL . 55.0 p -59.74 -20.2 55.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.673 0.273 . . . . 0.0 111.408 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.517 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -93.5 76.69 1.1 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.417 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.457 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . 135.53 -12.28 4.3 Favored Glycine 0 N--CA 1.453 -0.184 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.365 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.522 ' O ' ' HB3' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.4 -53.31 4.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.909 0.385 . . . . 0.0 110.593 179.589 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.552 HD13 HG23 ' A' ' 44' ' ' ILE . 0.5 OUTLIER -54.48 -11.52 0.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.224 -179.553 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -85.53 -51.89 6.2 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.162 179.845 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.98 -26.96 23.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.951 0.405 . . . . 0.0 110.251 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.532 ' CG ' HG13 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -77.67 -36.53 51.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.273 179.464 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.487 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 1.4 tmt? -50.4 -39.12 46.12 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.911 0.386 . . . . 0.0 110.705 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.89 -22.17 66.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.206 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.412 ' HB3' HG21 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -75.4 -42.4 53.85 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -179.396 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.614 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.0 OUTLIER -73.52 -24.53 60.16 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.121 0.486 . . . . 0.0 110.157 -179.989 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -82.77 -31.96 28.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.081 178.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -37.24 74.43 Favored 'General case' 0 C--O 1.231 0.079 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.674 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 1.004 HG21 ' HB2' ' A' ' 37' ' ' LEU . 84.9 t -54.29 -39.49 43.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.474 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 1.032 HD11 HD13 ' A' ' 89' ' ' ILE . 1.0 OUTLIER -75.84 -4.88 43.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.524 178.651 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -76.04 -56.81 4.31 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.572 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 7.9 tp10 -53.38 -38.04 62.99 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 122.098 0.951 . . . . 0.0 108.536 177.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.978 HD21 HG13 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -72.77 -67.17 0.58 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 113.485 -1.689 . . . . 0.0 111.939 -179.402 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.437 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 23.2 t-20 -50.68 -26.04 5.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.447 -179.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 21.9 m-20 -87.68 7.77 28.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.517 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.514 ' O ' ' N ' ' A' ' 76' ' ' GLN . 72.9 m-70 -154.09 31.92 0.44 Allowed 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.576 HD12 ' C ' ' A' ' 78' ' ' GLY . 0.2 OUTLIER -50.32 90.27 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.289 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -66.25 68.85 0.06 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.417 -177.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 58.44 24.78 56.81 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.75 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.576 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -130.96 46.23 1.09 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.236 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.46 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.2 OUTLIER -55.41 -32.5 62.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.693 0.283 . . . . 0.0 111.296 -179.697 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 37.4 p-80 -57.47 -33.43 67.97 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.052 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.68 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -67.15 -74.36 0.12 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.978 HG13 HD21 ' A' ' 71' ' ' LEU . 29.1 t -50.66 -42.06 21.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.2 179.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.467 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 42.4 t60 -48.83 -41.09 31.81 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.426 ' O ' ' HB3' ' A' ' 88' ' ' ASN . 84.7 t60 -76.47 -27.58 56.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.752 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 1.03 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.48 -33.1 7.48 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.149 -179.63 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.481 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -74.38 -45.71 45.1 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 179.102 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -59.14 -29.9 67.75 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 177.943 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.892 ' ND2' HG11 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -83.08 -58.63 2.77 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.494 179.344 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 1.032 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -60.57 -48.13 89.88 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.359 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.396 -179.313 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.425 ' N ' HG22 ' A' ' 89' ' ' ILE . 0.6 OUTLIER -61.5 -29.11 69.77 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 120.124 -0.631 . . . . 0.0 109.818 179.784 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -90.68 -2.41 57.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.196 178.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.774 HD13 ' O ' ' A' ' 88' ' ' ASN . 0.9 OUTLIER -77.82 -42.58 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.229 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.64 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -55.95 -27.95 54.76 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.13 178.842 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.64 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 16.9 t60 -62.39 -64.15 1.01 Allowed 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.25 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.434 ' HB3' HD11 ' A' ' 5' ' ' LEU . 4.7 m-70 -63.35 -9.86 13.99 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.127 178.499 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.758 HD21 ' HG ' ' A' ' 9' ' ' LEU . 32.7 mt -89.25 -63.37 1.3 Allowed 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.905 0.384 . . . . 0.0 110.317 179.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -63.36 -13.95 44.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.011 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -85.16 -28.7 25.32 Favored 'General case' 0 N--CA 1.458 -0.05 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.553 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.927 HD13 HD23 ' A' ' 5' ' ' LEU . 18.8 tp -62.66 -53.93 47.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.845 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.522 HG21 ' O ' ' A' ' 53' ' ' SER . 38.9 t -71.68 -27.84 29.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.36 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -94.83 33.57 1.46 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.142 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.911 179.851 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.805 -0.118 . . . . 0.0 112.805 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -59.13 -17.32 25.73 Favored 'General case' 0 CA--C 1.514 -0.412 0 O-C-N 122.825 -0.221 . . . . 0.0 111.136 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 1.048 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -50.46 -24.73 3.31 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.057 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.567 ' HA ' HD12 ' A' ' 9' ' ' LEU . 22.4 p-10 -57.95 -41.3 82.57 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.68 178.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -50.26 -30.99 12.99 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.179 0.514 . . . . 0.0 109.88 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.611 ' C ' HD13 ' A' ' 8' ' ' LEU . 2.4 tm? -84.96 -30.46 24.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.091 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.752 ' O ' HD23 ' A' ' 12' ' ' LEU . 15.5 mt -63.56 -34.36 77.64 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.563 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.77 -42.18 67.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.269 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.43 -46.81 69.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.945 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.902 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -58.31 -60.48 3.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.677 179.995 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.752 ' HA ' HD23 ' A' ' 16' ' ' LEU . 0.4 OUTLIER -52.59 -36.44 56.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.082 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -77.1 -29.91 55.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.249 -0.432 . . . . 0.0 109.901 179.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.878 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -64.09 -26.86 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.855 178.871 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' A' ' 13' ' ' GLN . 2.5 mm? -63.35 -35.91 81.96 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.694 178.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -42.98 -35.06 1.11 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.244 0.545 . . . . 0.0 110.076 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.672 ' HB3' HG23 ' A' ' 81' ' ' THR . 0.8 OUTLIER -78.38 -49.92 12.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.064 178.818 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.809 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -47.37 -43.64 23.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.468 -179.885 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.783 ' N ' HD23 ' A' ' 19' ' ' LEU . 30.1 m170 -49.49 -36.5 23.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.913 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.446 ' HE3' ' HB2' ' A' ' 20' ' ' HIS . 4.2 mmpt? -90.21 4.66 49.92 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.624 ' HB2' HG21 ' A' ' 81' ' ' THR . 9.8 m120 -148.61 18.59 1.03 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.998 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.927 ' CG ' HD23 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -88.05 -52.7 5.11 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.39 179.316 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.555 ' HB3' ' CZ2' ' A' ' 23' ' ' TRP . 10.6 t-160 179.94 52.1 0.0 OUTLIER 'General case' 0 C--O 1.232 0.153 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.223 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 70.63 120.62 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.255 0 N-CA-C 115.205 0.842 . . . . 0.0 115.205 177.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.78 130.02 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 115.207 -0.496 . . . . 0.0 114.321 177.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.457 ' HG3' ' CD2' ' A' ' 20' ' ' HIS . 3.5 ttpt -68.05 -14.85 63.29 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.398 -0.401 . . . . 0.0 110.023 178.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -46.79 -47.64 20.85 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.47 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -75.68 -46.98 28.21 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.801 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.927 HD23 ' CG ' ' A' ' 23' ' ' TRP . 0.3 OUTLIER -58.47 -28.02 64.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.004 0.43 . . . . 0.0 109.993 179.223 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.431 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 1.2 t60 -45.66 -48.76 14.87 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.451 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.09 -31.14 71.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.246 0.546 . . . . 0.0 110.142 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.931 ' CG1' HG13 ' A' ' 67' ' ' VAL . 2.4 t -72.32 -62.43 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.742 179.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.432 ' N ' HG12 ' A' ' 33' ' ' VAL . 0.8 OUTLIER -61.53 -21.57 64.37 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.307 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.431 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 0.6 OUTLIER -60.13 -41.18 92.14 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 177.312 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.633 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.3 OUTLIER -64.69 -49.74 69.76 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 177.205 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.034 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -51.92 -67.15 0.27 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.763 178.505 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.28 -42.88 10.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.812 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.9 m-20 -58.25 -30.32 66.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.031 179.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.767 HG12 HG13 ' A' ' 44' ' ' ILE . 21.7 t -65.19 -50.31 74.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.162 179.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.856 HD11 HD21 ' A' ' 12' ' ' LEU . 12.5 mm -44.24 -41.15 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.758 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.618 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 0.5 OUTLIER -72.65 -29.89 63.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.703 0.287 . . . . 0.0 111.018 -179.743 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.537 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.3 OUTLIER -84.32 -26.39 28.53 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 178.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.767 HG13 HG12 ' A' ' 40' ' ' VAL . 6.4 mm -87.3 -50.57 13.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.353 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.618 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -67.21 -26.95 66.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.353 -179.597 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.524 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 9.9 t0 -86.48 -40.87 14.87 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 121.039 0.447 . . . . 0.0 110.054 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.537 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.4 m-85 -73.72 -25.41 60.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.442 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.738 ' SD ' HG22 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -50.62 -39.11 49.39 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.001 0.429 . . . . 0.0 110.83 179.466 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -67.04 -25.29 66.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.757 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 130.12 -3.41 5.95 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.894 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.91 -36.32 26.68 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.141 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.4 ' HA3' ' CD2' ' A' ' 47' ' ' PHE . . . -162.56 25.13 0.22 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 121.054 -0.594 . . . . 0.0 112.178 179.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.89 -175.87 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.899 0.38 . . . . 0.0 110.98 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 50.02 59.7 7.27 Favored Glycine 0 CA--C 1.517 0.217 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.66 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 147.9 -19.76 1.43 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.624 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.446 ' O ' ' CB ' ' A' ' 60' ' ' MET . 3.6 pptp? -88.18 -41.28 13.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.778 0.323 . . . . 0.0 111.023 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.672 HD11 ' HB3' ' A' ' 96' ' ' LEU . 14.1 tp -65.55 -9.72 28.86 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.884 -179.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -86.3 -49.41 7.7 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.826 179.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -87.31 -31.17 20.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.439 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.675 ' HG3' HG13 ' A' ' 40' ' ' VAL . 1.3 tpt -77.54 -30.82 52.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.845 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.52 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -56.24 -43.0 78.22 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.265 179.678 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.79 -20.18 63.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.02 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -74.29 -29.42 61.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.464 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.826 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.4 p90 -87.08 -28.97 22.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.962 0.411 . . . . 0.0 110.682 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.46 ' CG ' ' CE1' ' A' ' 64' ' ' PHE . 4.1 mt-30 -81.23 -34.14 32.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.92 179.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 9.0 tm0? -56.58 -35.13 67.85 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.855 0.36 . . . . 0.0 110.787 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 1.034 HG21 ' HB2' ' A' ' 37' ' ' LEU . 9.5 t -55.62 -49.11 76.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.327 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.986 HD11 HD13 ' A' ' 89' ' ' ILE . 1.2 mp -65.1 -10.85 33.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.738 179.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -69.54 -59.86 2.7 Favored 'General case' 0 N--CA 1.458 -0.068 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.483 ' CG ' ' CZ3' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -48.91 -40.91 31.83 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 122.232 1.015 . . . . 0.0 109.198 177.769 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.918 HD21 HG13 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -69.99 -67.78 0.46 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 113.313 -1.767 . . . . 0.0 112.207 -179.279 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.503 ' ND2' HG11 ' A' ' 82' ' ' VAL . 14.2 m120 -49.24 -30.0 6.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.033 -179.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -87.4 9.4 20.79 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.628 0.232 . . . . 0.0 111.628 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.507 ' O ' ' N ' ' A' ' 76' ' ' GLN . 85.4 m-70 -151.98 27.89 0.61 Allowed 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.636 HD11 HG23 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -51.38 89.34 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 178.32 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.507 ' N ' ' O ' ' A' ' 74' ' ' HIS . 3.9 mm-40 -66.36 68.09 0.06 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.19 -178.352 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.421 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 56.36 46.56 86.72 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.66 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.437 ' HA3' ' ND2' ' A' ' 22' ' ' ASN . . . -152.21 39.39 0.76 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.502 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.48 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -46.89 -39.73 12.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.716 0.293 . . . . 0.0 111.332 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 31.7 t60 -47.99 -33.57 8.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.55 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.672 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.3 m -67.97 -73.53 0.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.262 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.918 HG13 HD21 ' A' ' 71' ' ' LEU . 25.3 t -50.15 -40.31 17.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.037 179.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.475 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 10.3 t60 -48.91 -41.14 32.61 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -76.61 -28.87 56.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.801 178.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.96 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.28 -31.16 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.137 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.012 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -76.01 -48.41 21.13 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.568 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.77 -30.06 60.64 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 177.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.691 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.9 m-80 -83.08 -59.52 2.45 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.676 179.152 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.986 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -60.96 -50.32 81.05 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.882 -179.323 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.512 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 1.3 mptp? -61.43 -29.09 69.72 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.878 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -90.69 0.13 57.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.982 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.691 HD13 ' O ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER -78.67 -45.01 25.66 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.031 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.637 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -53.05 -26.35 15.59 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.081 178.419 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.637 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.7 OUTLIER -60.29 -64.22 1.03 Allowed 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.296 -179.365 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.843 ' HB3' HD11 ' A' ' 5' ' ' LEU . 21.8 m-70 -66.02 -9.52 31.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.351 178.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.672 ' HB3' HD11 ' A' ' 57' ' ' LEU . 34.9 mt -89.17 -58.16 2.64 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 120.944 0.402 . . . . 0.0 110.442 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.461 ' N ' HD21 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -70.68 -10.93 60.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.061 178.78 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -90.7 -12.99 35.01 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.969 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 1.048 HD13 HD23 ' A' ' 5' ' ' LEU . 4.5 tp -87.11 -56.58 3.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.002 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 45.9 t -62.98 -46.03 97.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.273 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -60.04 -30.03 68.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.011 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.145 -0.931 . . . . 0.0 110.857 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 CA-C-O 120.41 -0.105 . . . . 0.0 113.068 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -82.31 -21.63 36.0 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 116.856 0.328 . . . . 0.0 110.971 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.79 HD23 HD13 ' A' ' 99' ' ' LEU . 0.2 OUTLIER -51.26 -21.98 2.46 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.371 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.458 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 8.5 t30 -62.46 -40.41 96.54 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.789 178.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -50.44 -30.12 11.83 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.226 0.536 . . . . 0.0 109.745 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.753 ' O ' HD13 ' A' ' 8' ' ' LEU . 2.9 tm? -85.67 -27.71 25.19 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.953 178.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.73 ' O ' HD23 ' A' ' 12' ' ' LEU . 13.4 mt -70.83 -13.06 61.9 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.092 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -75.4 -42.21 54.27 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.805 0.336 . . . . 0.0 111.322 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -56.53 -48.17 77.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.186 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.922 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -54.78 -58.84 5.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.632 -179.874 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.723 ' HA ' HD23 ' A' ' 16' ' ' LEU . 1.4 tt0 -52.38 -35.54 51.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.955 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.87 -28.18 49.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.973 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.87 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -67.64 -26.8 36.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.196 179.286 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.723 HD23 ' HA ' ' A' ' 13' ' ' GLN . 2.4 mm? -62.85 -36.15 82.28 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.247 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.432 ' HA ' ' CE ' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -46.66 -40.27 12.85 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.047 0.451 . . . . 0.0 109.933 179.397 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.579 ' HB3' HG23 ' A' ' 81' ' ' THR . 0.6 OUTLIER -68.21 -41.01 81.94 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.241 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.935 HD12 HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -57.22 -38.37 73.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.737 179.534 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.953 ' CE1' HD12 ' A' ' 30' ' ' LEU . 39.8 m-70 -51.68 -34.84 40.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.853 0.359 . . . . 0.0 111.144 179.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.533 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.7 mmpt? -94.15 2.36 55.97 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -178.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.675 ' HB2' HG21 ' A' ' 81' ' ' THR . 0.7 OUTLIER -139.54 5.75 2.24 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -179.548 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.987 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -80.47 -37.11 32.47 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.109 179.41 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.494 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 86.0 t60 -176.75 -49.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.736 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 146.86 132.38 2.31 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.102 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 80.48 101.25 0.31 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.522 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.84 -25.45 7.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.753 0.311 . . . . 0.0 110.451 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.81 -31.48 49.28 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.432 179.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -85.25 -42.88 14.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.343 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.987 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.2 tm? -62.76 -34.72 77.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.923 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.474 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 33.7 t-80 -47.74 -39.49 17.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.214 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -76.59 -21.89 54.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.676 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.823 ' O ' HG22 ' A' ' 67' ' ' VAL . 1.6 p -91.66 -46.73 14.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.716 -0.22 . . . . 0.0 111.254 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.581 ' HB2' HD11 ' A' ' 30' ' ' LEU . 2.7 t70 -72.97 -27.16 61.65 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.264 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 1.1 t30 -53.94 -32.68 54.48 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 178.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.863 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -63.73 -34.36 77.69 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.287 178.384 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.676 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -71.3 -66.3 0.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.195 179.202 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -47.37 -35.69 8.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.015 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -70.16 -31.71 69.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.229 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.87 HG12 HD11 ' A' ' 44' ' ' ILE . 49.5 t -71.49 -36.9 62.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.213 179.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.669 HD11 HD21 ' A' ' 12' ' ' LEU . 35.2 mm -49.79 -35.42 10.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.851 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.572 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -75.64 -25.39 56.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.202 179.326 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.564 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 3.3 m-20 -82.19 -27.24 32.73 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.621 178.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.87 HD11 HG12 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -87.08 -52.71 11.33 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.121 179.321 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.572 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -62.13 -27.31 68.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.707 0.289 . . . . 0.0 110.701 -179.733 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.51 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 11.7 t0 -86.83 -32.55 20.23 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.087 0.47 . . . . 0.0 110.161 179.446 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.564 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.3 m-85 -81.6 -45.87 15.21 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.703 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.425 ' HB3' ' HE2' ' A' ' 48' ' ' MET . 11.5 ptp -50.23 -24.4 2.84 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.446 -179.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -89.92 13.14 15.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.628 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 104.73 25.94 6.65 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.787 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -102.14 27.01 22.28 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.561 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 101.78 27.34 7.13 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.543 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.522 ' O ' HG11 ' A' ' 100' ' ' VAL . 0.1 OUTLIER -64.89 -15.73 62.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.659 0.266 . . . . 0.0 111.35 -179.917 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.46 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -85.82 73.26 2.59 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.61 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 131.92 -12.43 5.33 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.635 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.534 ' HZ3' ' HB3' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.39 -28.14 21.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.612 0.244 . . . . 0.0 110.956 -179.881 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.517 ' O ' ' HB2' ' A' ' 61' ' ' MET . 0.4 OUTLIER -70.16 -9.2 54.92 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 121.021 -0.272 . . . . 0.0 111.722 -179.679 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.402 ' CG ' ' N ' ' A' ' 59' ' ' GLU . 15.1 pt20 -86.77 -50.81 6.48 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.615 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.402 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 0.4 OUTLIER -86.22 -31.74 21.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.802 -179.726 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.534 ' HB3' ' HZ3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -78.39 -30.8 48.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.098 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.517 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -59.37 -41.75 90.05 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.316 179.708 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -60.78 -19.47 59.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.576 179.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.622 ' HB3' HG21 ' A' ' 40' ' ' VAL . 15.8 tt0 -74.26 -31.35 62.52 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.508 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.558 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.0 OUTLIER -87.41 -26.37 23.33 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.01 0.433 . . . . 0.0 109.891 179.608 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -82.51 -32.2 28.83 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.877 178.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -59.03 -33.62 70.95 Favored 'General case' 0 C--O 1.23 0.063 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.488 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.823 HG22 ' O ' ' A' ' 33' ' ' VAL . 87.9 t -54.96 -38.35 45.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.178 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 1.039 HD21 HG13 ' A' ' 85' ' ' ILE . 1.8 mp -74.98 -7.55 53.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.513 178.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -74.31 -59.45 2.72 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.501 ' HB3' HG21 ' A' ' 33' ' ' VAL . 6.8 tp10 -51.67 -34.48 38.48 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 122.029 0.919 . . . . 0.0 108.786 177.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.935 HD13 HD12 ' A' ' 19' ' ' LEU . 0.3 OUTLIER -72.53 -65.78 0.74 Allowed 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 113.613 -1.631 . . . . 0.0 111.806 -179.418 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.482 ' HA ' HD22 ' A' ' 75' ' ' LEU . 15.1 t-20 -51.18 -24.27 4.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.851 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -85.14 2.78 42.08 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -179.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.578 ' O ' ' N ' ' A' ' 76' ' ' GLN . 2.4 m-70 -151.53 36.34 0.57 Allowed 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.677 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.663 HD11 HG23 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -52.08 86.55 0.0 OUTLIER 'General case' 0 C--O 1.231 0.119 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.733 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.578 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -79.16 -39.17 34.14 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.485 -177.399 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -101.1 25.15 29.36 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 120.505 -0.855 . . . . 0.0 114.077 -178.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 88.8 127.32 2.9 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.855 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.561 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -50.46 -19.97 1.01 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.606 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -40.86 -38.16 0.9 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.749 0.309 . . . . 0.0 111.615 -179.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.675 HG21 ' HB2' ' A' ' 22' ' ' ASN . 1.3 m -69.48 -73.34 0.16 Allowed 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 178.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.791 ' CG1' HD21 ' A' ' 71' ' ' LEU . 41.8 t -47.39 -37.02 4.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.975 179.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.505 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -50.52 -41.46 53.75 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.1 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -76.43 -27.9 56.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.537 178.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 1.039 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -84.07 -33.98 9.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.731 179.972 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.587 ' O ' ' HB2' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -74.31 -51.7 14.43 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 178.939 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.426 ' NE2' ' HA ' ' A' ' 87' ' ' GLN . 3.0 mm-40 -54.16 -28.19 38.61 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.245 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -83.01 -67.12 0.81 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.08 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.969 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -50.46 -33.45 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.528 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.587 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 0.9 OUTLIER -67.75 -24.82 65.39 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.717 -0.793 . . . . 0.0 109.609 179.798 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -86.88 -4.95 59.23 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.075 178.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.834 HD13 ' HA ' ' A' ' 89' ' ' ILE . 1.7 mp -78.47 -57.86 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 179.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.489 ' CD1' ' C ' ' A' ' 93' ' ' PHE . 0.2 OUTLIER -46.12 -44.79 16.0 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.561 178.958 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.48 ' N ' ' CG ' ' A' ' 93' ' ' PHE . 1.1 t60 -57.92 -61.4 2.56 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.958 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.594 ' HB3' HD11 ' A' ' 5' ' ' LEU . 1.4 m-70 -61.44 -12.19 13.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.526 178.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.675 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 20.3 mt -89.25 -65.47 1.01 Allowed 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.927 0.394 . . . . 0.0 110.494 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -64.12 -14.07 52.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.201 179.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.432 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 3.5 tp10 -86.7 -24.98 25.01 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.559 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.79 HD13 HD23 ' A' ' 5' ' ' LEU . 7.5 tp -70.46 -57.14 5.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.626 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.522 HG11 ' O ' ' A' ' 53' ' ' SER . 42.3 t -60.09 -28.47 41.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.18 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -96.08 32.99 1.8 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.136 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.862 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.244 0 CA-C-O 120.417 -0.102 . . . . 0.0 113.007 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.412 ' HA ' ' CE ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -60.44 -18.83 53.63 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 116.807 0.303 . . . . 0.0 111.38 -179.727 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.76 HD13 ' HB3' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -52.84 -20.99 3.69 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.352 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.497 ' HA ' HD12 ' A' ' 9' ' ' LEU . 24.4 p-10 -54.3 -44.71 72.21 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.362 178.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -53.83 -29.43 40.92 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.76 ' HB3' HD13 ' A' ' 5' ' ' LEU . 1.5 tm? -87.41 -28.61 22.04 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.782 178.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.83 ' O ' HD23 ' A' ' 12' ' ' LEU . 10.7 mt -60.11 -35.67 75.76 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 121.179 0.514 . . . . 0.0 109.85 179.372 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -55.37 -37.7 67.87 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.153 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.2 -53.01 39.07 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.965 0.412 . . . . 0.0 110.725 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.898 ' O ' HG12 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -54.78 -57.1 12.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.322 179.55 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.671 ' HA ' HD23 ' A' ' 16' ' ' LEU . 31.0 tt0 -52.18 -36.48 51.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.795 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.57 -30.66 57.13 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.898 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -62.81 -26.23 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.828 178.753 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.692 HD12 HD13 ' A' ' 19' ' ' LEU . 3.2 mm? -65.52 -32.77 74.55 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.539 178.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.18 -37.11 2.96 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.232 0.539 . . . . 0.0 110.146 179.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.661 ' HB3' HG23 ' A' ' 81' ' ' THR . 11.1 m120 -77.4 -49.21 15.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.986 178.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.848 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -43.22 -49.33 6.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.818 -179.88 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.836 ' CD2' HD12 ' A' ' 30' ' ' LEU . 41.0 m80 -48.21 -40.54 24.66 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -179.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.487 ' HE3' ' HB2' ' A' ' 20' ' ' HIS . 2.8 mmpt? -87.25 7.61 27.73 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -177.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.583 ' HB2' HG21 ' A' ' 81' ' ' THR . 70.0 m-80 -153.93 19.25 0.51 Allowed 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.315 -0.554 . . . . 0.0 112.195 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.78 ' CB ' HD12 ' A' ' 71' ' ' LEU . 0.5 OUTLIER -87.05 -33.7 19.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.986 0.422 . . . . 0.0 110.08 178.972 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.51 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 3.7 t60 -177.15 -51.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.579 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 160.26 130.26 1.11 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.464 -0.874 . . . . 0.0 113.12 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.68 120.39 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.74 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HD2' ' CG ' ' A' ' 20' ' ' HIS . 18.8 tttt -62.22 -18.64 61.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.651 0.262 . . . . 0.0 110.771 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -50.25 -41.01 49.51 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.98 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -77.86 -49.49 14.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.491 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.836 HD12 ' CD2' ' A' ' 20' ' ' HIS . 1.4 tm? -56.42 -30.23 62.55 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.3 OUTLIER -45.79 -43.96 13.63 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.995 179.993 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.64 -26.23 64.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.081 0.467 . . . . 0.0 110.54 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.887 ' CG1' HG13 ' A' ' 67' ' ' VAL . 2.3 t -83.5 -62.29 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.888 179.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.701 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -58.5 -23.05 57.03 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.333 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 0.7 OUTLIER -59.73 -41.08 90.11 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 177.77 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.797 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.8 OUTLIER -62.69 -49.48 74.94 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 177.485 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.002 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -56.15 -68.71 0.18 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.571 178.358 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -47.13 -43.86 21.07 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.27 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -61.24 -27.99 68.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.551 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 36' ' ' HIS . 68.0 t -76.0 -41.48 38.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.557 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.793 HD11 HD21 ' A' ' 12' ' ' LEU . 25.9 mm -47.91 -36.8 5.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.164 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.58 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -71.8 -29.1 64.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.433 179.646 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.555 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 13.7 m-20 -84.19 -27.27 28.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.931 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.732 HG13 HG12 ' A' ' 40' ' ' VAL . 1.8 mt -86.85 -52.77 11.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.188 179.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.58 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -62.7 -28.12 69.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.237 -179.782 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.52 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 39.0 t0 -86.77 -38.68 16.66 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 120.961 0.41 . . . . 0.0 110.316 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.555 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.2 m-85 -77.68 -24.01 49.41 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.711 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.481 ' CE ' HD13 ' A' ' 99' ' ' LEU . 0.8 OUTLIER -52.41 -36.98 55.56 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 121.093 0.473 . . . . 0.0 110.502 179.482 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -71.67 -11.22 60.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.124 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 118.62 20.78 4.13 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.752 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -86.37 27.56 5.64 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.44 -0.886 . . . . 0.0 111.954 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.405 ' O ' ' HG2' ' A' ' 56' ' ' LYS . . . 115.7 27.39 3.05 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.121 -0.561 . . . . 0.0 112.12 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.514 ' O ' HG22 ' A' ' 100' ' ' VAL . 16.4 t -85.76 36.51 0.66 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.753 0.311 . . . . 0.0 111.611 -179.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -107.1 -32.89 3.36 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.586 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.427 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . -135.62 7.95 4.26 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.986 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.562 ' HE3' ' HA ' ' A' ' 44' ' ' ILE . 0.0 OUTLIER -88.6 -41.14 12.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.983 0.42 . . . . 0.0 111.375 179.959 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.497 ' O ' ' CB ' ' A' ' 61' ' ' MET . 49.8 tp -60.26 -11.68 7.01 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.817 -0.628 . . . . 0.0 112.289 -178.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 1.7 pp0? -86.24 -50.31 7.06 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.657 -0.417 . . . . 0.0 111.202 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.97 -32.23 20.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.827 0.346 . . . . 0.0 110.454 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.529 ' CG ' HG13 ' A' ' 40' ' ' VAL . 29.9 tpp -75.73 -29.78 59.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.473 179.564 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.497 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 3.0 ttt -52.58 -40.74 62.93 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.905 0.383 . . . . 0.0 110.312 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.6 tptt -63.07 -24.21 67.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.857 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.656 ' HB3' HG21 ' A' ' 40' ' ' VAL . 13.2 tt0 -70.28 -30.88 68.02 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.385 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.8 ' HA ' HD22 ' A' ' 37' ' ' LEU . 0.8 OUTLIER -86.96 -30.04 21.59 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.085 0.469 . . . . 0.0 110.228 179.866 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -82.4 -31.62 29.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.568 179.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -59.36 -37.16 77.18 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.786 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 1.002 HG21 ' HB2' ' A' ' 37' ' ' LEU . 3.9 t -53.39 -42.75 49.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.434 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 1.016 HD21 HG13 ' A' ' 85' ' ' ILE . 0.8 OUTLIER -70.76 -7.09 42.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.858 179.306 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -73.37 -55.96 5.69 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.648 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 2.6 tp10 -53.69 -38.01 63.8 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 122.018 0.913 . . . . 0.0 108.885 177.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.995 HD21 HG13 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -75.05 -70.82 0.39 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 113.686 -1.597 . . . . 0.0 112.283 -178.928 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.41 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 8.0 p-10 -49.32 -27.38 3.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.608 -179.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.409 ' N ' ' OD1' ' A' ' 72' ' ' ASN . 2.9 t-20 -91.69 13.65 17.48 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.271 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.467 ' O ' ' N ' ' A' ' 76' ' ' GLN . 63.0 m-70 -151.96 24.31 0.66 Allowed 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.581 ' CD2' HG21 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -47.63 94.74 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.887 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.467 ' N ' ' O ' ' A' ' 74' ' ' HIS . 9.9 tp60 -59.39 -61.61 2.5 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.34 -177.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.4 31.78 0.44 Allowed Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.235 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.432 ' O ' ' HB ' ' A' ' 81' ' ' THR . . . -141.15 49.36 0.78 Allowed Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.804 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.454 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -48.63 -27.52 2.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.716 0.293 . . . . 0.0 110.882 179.623 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -67.5 -26.92 66.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.954 179.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.661 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -68.04 -75.1 0.11 Allowed 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 179.274 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.995 HG13 HD21 ' A' ' 71' ' ' LEU . 21.3 t -48.3 -42.95 11.84 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.765 179.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.495 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 1.8 t60 -47.93 -42.05 26.29 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.226 0.536 . . . . 0.0 109.797 179.235 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.3 m80 -76.44 -28.42 56.58 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.675 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 1.016 HG13 HD21 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -85.48 -29.99 6.46 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.178 -179.616 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -76.75 -46.82 23.78 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 178.869 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.403 ' NE2' ' HA ' ' A' ' 87' ' ' GLN . 4.5 mm-40 -60.67 -27.91 68.2 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.18 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.719 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.7 m-80 -83.05 -58.31 2.91 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.263 178.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.988 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -62.17 -47.99 90.55 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.287 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.32 -179.739 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.45 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -61.69 -28.37 69.35 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.042 -0.663 . . . . 0.0 109.724 179.735 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -90.56 -1.26 57.88 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.09 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.719 HD13 ' O ' ' A' ' 88' ' ' ASN . 0.9 OUTLIER -78.64 -44.09 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.287 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.638 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -55.06 -27.0 41.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.137 178.585 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.638 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 2.6 t-160 -62.75 -59.8 4.38 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.853 -179.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.45 ' O ' ' HG2' ' A' ' 98' ' ' GLU . 38.9 m170 -67.3 -11.03 56.53 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.189 178.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.583 ' HA ' HD12 ' A' ' 99' ' ' LEU . 36.6 mt -90.0 -56.97 3.02 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.004 0.431 . . . . 0.0 110.818 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -65.23 -10.63 33.46 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.472 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 95' ' ' HIS . 14.2 pt-20 -81.97 -28.07 32.87 Favored 'General case' 0 N--CA 1.461 0.091 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.508 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.716 HD21 HD23 ' A' ' 5' ' ' LEU . 1.7 mt -69.43 -64.05 0.95 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.183 0.516 . . . . 0.0 110.639 179.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 53' ' ' SER . 21.7 t -59.77 -26.58 35.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.012 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -85.39 -35.15 21.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.775 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.405 ' CB ' ' O ' ' A' ' 98' ' ' GLU . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.141 -0.933 . . . . 0.0 110.873 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 CA-C-O 120.415 -0.103 . . . . 0.0 112.892 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.8 tpmt? -84.12 -17.73 39.14 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 116.765 0.282 . . . . 0.0 110.649 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.93 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -53.79 -20.63 5.96 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 177.985 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.435 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 35.5 p-10 -61.2 -42.6 98.87 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.677 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -49.43 -29.47 6.54 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.17 0.509 . . . . 0.0 109.802 179.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.537 ' O ' HD13 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -84.39 -34.46 23.57 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.067 179.038 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.715 ' O ' HD23 ' A' ' 12' ' ' LEU . 7.8 mt -64.07 -29.56 70.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.082 0.468 . . . . 0.0 110.598 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.63 -49.94 64.14 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.337 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -54.52 -46.07 73.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.881 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.991 ' O ' HG12 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -54.53 -61.0 2.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.491 179.747 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.809 ' HA ' HD23 ' A' ' 16' ' ' LEU . 4.9 tt0 -52.76 -37.42 59.42 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.617 -179.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.41 -30.26 53.47 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.035 0.445 . . . . 0.0 110.052 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.991 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.9 OUTLIER -64.96 -27.48 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.104 178.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.969 HD13 HD11 ' A' ' 85' ' ' ILE . 2.6 mm? -61.63 -39.69 92.19 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 178.291 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.3 ttpt -39.14 -39.55 0.6 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.005 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.812 ' HB3' HG23 ' A' ' 81' ' ' THR . 7.4 m-20 -66.01 -55.68 15.47 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.419 -0.809 . . . . 0.0 108.982 178.018 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.905 HD21 HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -39.47 -47.57 1.86 Allowed 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 114.561 -1.2 . . . . 0.0 111.969 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.998 ' CE1' HD12 ' A' ' 30' ' ' LEU . 42.6 m-70 -50.64 -37.03 38.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.58 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.6 mmpt? -94.23 8.37 42.0 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -177.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.589 ' HB2' HG21 ' A' ' 81' ' ' THR . 35.0 m120 -152.69 10.14 0.48 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.143 -0.623 . . . . 0.0 112.57 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 1.041 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -75.16 -34.71 61.62 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.846 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.51 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 81.7 t60 -178.41 -50.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.672 178.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -130.88 -91.68 0.57 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.027 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -136.11 -142.52 4.51 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.888 -0.672 . . . . 0.0 111.785 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.426 ' HA ' ' HB3' ' A' ' 30' ' ' LEU . 9.8 tttm -93.62 -18.53 22.08 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.612 0.244 . . . . 0.0 111.125 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -54.66 -56.31 20.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.804 0.335 . . . . 0.0 110.928 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -79.96 -17.41 53.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.021 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.041 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.2 tm? -80.9 -31.74 35.06 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.038 0.447 . . . . 0.0 109.936 179.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.426 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.4 OUTLIER -51.47 -36.91 46.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.116 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -76.57 -25.22 53.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.505 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.778 ' CG1' HD22 ' A' ' 30' ' ' LEU . 1.5 p -90.35 -42.71 14.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.062 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.498 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 1.2 t0 -73.13 -31.77 64.5 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 179.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 13.1 t-20 -51.97 -29.55 21.08 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.798 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.9 OUTLIER -72.69 -36.41 67.87 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.344 -0.844 . . . . 0.0 109.408 178.574 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.771 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -68.45 -66.81 0.52 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.38 179.267 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -45.39 -36.0 3.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.307 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -65.99 -31.07 71.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.943 0.402 . . . . 0.0 110.39 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.847 HG12 ' CG1' ' A' ' 44' ' ' ILE . 32.6 t -64.55 -53.86 37.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.8 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.816 HD11 HD21 ' A' ' 12' ' ' LEU . 38.3 mm -38.1 -42.35 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.935 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -71.7 -39.68 70.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.793 0.33 . . . . 0.0 110.405 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.473 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.7 OUTLIER -71.72 -28.64 63.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.549 179.399 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.847 ' CG1' HG12 ' A' ' 40' ' ' VAL . 7.1 mm -86.83 -40.53 14.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.867 0.365 . . . . 0.0 110.686 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.687 ' NE2' HG23 ' A' ' 41' ' ' ILE . 13.7 m170 -73.87 -39.01 64.26 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.345 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -74.38 -26.09 59.89 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.473 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.6 m-85 -88.61 -46.19 9.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.979 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.44 ' HE1' ' N ' ' A' ' 5' ' ' LEU . 8.4 ptm -46.49 -32.38 3.29 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.84 0.352 . . . . 0.0 111.406 -179.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -26.57 66.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.244 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 146.52 -13.75 1.59 Allowed Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.599 -0.81 . . . . 0.0 113.009 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.73 -42.65 37.13 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.86 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 168.69 39.2 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.607 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.432 ' HB3' ' HA ' ' A' ' 48' ' ' MET . 7.8 p -59.35 -24.38 63.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.735 0.302 . . . . 0.0 111.032 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.7 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -88.95 57.93 4.02 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.298 179.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 171.14 -28.1 0.11 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.937 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.609 ' HE3' HD13 ' A' ' 44' ' ' ILE . 0.6 OUTLIER -87.94 -30.04 20.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.921 0.361 . . . . 0.0 110.974 -179.866 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.601 HD13 ' HZ1' ' A' ' 56' ' ' LYS . 12.8 tp -61.53 -10.92 8.97 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.046 -0.261 . . . . 0.0 111.602 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.421 ' CG ' ' N ' ' A' ' 59' ' ' GLU . 13.4 pt20 -85.75 -49.86 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.751 -0.38 . . . . 0.0 110.798 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.421 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 19.7 mm-40 -87.42 -33.8 18.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.133 0.492 . . . . 0.0 110.295 179.342 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.728 ' HG3' HG13 ' A' ' 40' ' ' VAL . 3.5 tpt -74.6 -27.19 60.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.834 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.503 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 3.9 ttp -58.48 -47.61 83.49 Favored 'General case' 0 C--O 1.231 0.086 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.013 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -62.28 -24.51 67.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.512 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.426 ' HG2' HG22 ' A' ' 40' ' ' VAL . 1.1 tp10 -67.8 -32.29 72.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.318 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.555 ' HA ' HD22 ' A' ' 37' ' ' LEU . 0.9 OUTLIER -86.99 -33.47 19.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.888 0.375 . . . . 0.0 110.511 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.404 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 10.2 tt0 -80.76 -32.8 35.41 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.997 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.66 -33.09 71.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.768 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.771 HG22 ' O ' ' A' ' 33' ' ' VAL . 95.1 t -58.46 -44.32 88.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.57 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 1.062 HD11 HD13 ' A' ' 89' ' ' ILE . 1.3 mp -73.21 -6.37 45.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.78 179.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -73.1 -54.37 8.68 Favored 'General case' 0 N--CA 1.457 -0.122 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.508 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 5.3 tp10 -57.95 -31.72 67.12 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.881 0.848 . . . . 0.0 108.967 177.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 1.01 ' CD2' HG13 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -76.98 -72.04 0.37 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.905 -1.498 . . . . 0.0 112.378 -178.8 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.53 ' HA ' HG11 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -51.45 -26.13 7.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.46 -179.171 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -86.45 8.15 22.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.166 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.527 ' O ' ' N ' ' A' ' 76' ' ' GLN . 36.5 m-70 -146.41 29.46 1.05 Allowed 'General case' 0 CA--C 1.523 -0.094 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.586 HD11 HG23 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -49.93 88.9 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.236 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 74' ' ' HIS . 1.4 tm0? -62.37 -48.75 78.38 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.94 0.4 . . . . 0.0 110.76 -178.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -172.54 34.91 0.13 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.334 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.442 ' HA3' ' ND2' ' A' ' 22' ' ' ASN . . . -142.55 49.77 0.73 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.659 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.442 ' N ' ' HD2' ' A' ' 79' ' ' LYS . 0.0 OUTLIER -45.5 -36.26 4.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.618 0.246 . . . . 0.0 111.246 179.952 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 36.0 m80 -59.72 -40.78 89.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.605 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.9 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.4 m -59.28 -64.47 0.93 Allowed 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.939 179.118 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 1.01 HG13 ' CD2' ' A' ' 71' ' ' LEU . 9.5 t -60.05 -49.29 84.6 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.093 -179.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.521 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 1.4 m-70 -50.77 -40.23 54.48 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.946 -0.301 . . . . 0.0 110.773 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 -75.41 -56.4 4.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.909 0.385 . . . . 0.0 110.28 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.969 HD11 HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -58.33 -32.98 46.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.751 179.477 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.619 ' HA ' HD22 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -81.16 -39.87 24.85 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.638 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.521 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 1.1 mp0 -66.79 -25.94 66.71 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 177.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.791 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.4 m-80 -82.65 -52.96 6.31 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.746 178.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 1.062 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -66.18 -50.49 68.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.932 179.843 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.502 ' N ' HG22 ' A' ' 89' ' ' ILE . 0.3 OUTLIER -56.96 -27.31 61.07 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 120.43 -0.508 . . . . 0.0 109.991 -179.855 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -90.7 -5.34 55.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.354 178.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.791 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.0 OUTLIER -78.6 -46.2 24.97 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 179.38 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.622 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.2 OUTLIER -48.53 -28.92 3.69 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.348 178.976 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.622 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.5 OUTLIER -60.12 -62.99 1.46 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.102 -179.518 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.494 ' HB3' HD11 ' A' ' 5' ' ' LEU . 1.7 m-70 -68.07 -8.72 40.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.345 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.482 ' HB2' ' HA ' ' A' ' 93' ' ' PHE . 23.0 mt -88.52 -56.17 3.42 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.995 0.426 . . . . 0.0 110.009 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.412 ' HG2' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -71.63 -9.81 58.81 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.824 178.486 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -88.16 -30.5 19.74 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.514 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.93 HD13 HD23 ' A' ' 5' ' ' LEU . 10.8 tp -67.6 -56.07 10.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.918 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.7 HG11 ' HA2' ' A' ' 54' ' ' GLY . 21.2 t -62.2 -37.99 79.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.417 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -63.73 -39.22 93.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.938 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.874 179.94 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.4 mtm . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.747 0.308 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -59.97 121.78 12.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.693 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.449 ' HA2' ' HB3' ' A' ' 48' ' ' MET . . . -179.5 -38.3 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.553 -0.832 . . . . 0.0 112.788 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.0 tptt -62.97 -17.42 62.04 Favored 'General case' 0 CA--C 1.513 -0.455 0 O-C-N 122.809 -0.23 . . . . 0.0 111.327 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 1.089 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -52.88 -23.43 7.07 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.005 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.415 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 39.4 p-10 -61.25 -39.69 91.27 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.851 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -50.13 -29.61 9.48 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.079 0.466 . . . . 0.0 110.185 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.6 ' C ' HD13 ' A' ' 8' ' ' LEU . 1.8 tm? -87.66 -29.35 21.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.281 179.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.686 ' HB3' HD11 ' A' ' 41' ' ' ILE . 11.1 mt -67.74 -35.54 78.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.563 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -51.78 -47.8 64.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.664 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -49.16 -46.29 45.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.26 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.907 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -55.46 -58.71 6.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.762 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.527 ' HA ' HD23 ' A' ' 16' ' ' LEU . 40.2 tt0 -55.16 -37.73 67.37 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.336 -179.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -76.41 -26.46 55.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.87 0.367 . . . . 0.0 110.175 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.874 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -69.87 -27.28 32.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.345 179.31 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.712 ' CD1' HD13 ' A' ' 19' ' ' LEU . 2.7 mm? -62.63 -40.39 96.83 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.179 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -41.24 -39.74 1.43 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.069 0.462 . . . . 0.0 110.54 179.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.668 ' HB3' HG23 ' A' ' 81' ' ' THR . 1.1 m-20 -70.7 -47.04 61.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.528 178.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.912 HD21 HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -47.67 -40.81 20.88 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.392 179.806 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 1.091 ' CE1' HD12 ' A' ' 30' ' ' LEU . 63.5 m-70 -52.48 -39.29 61.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.908 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.542 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 3.9 mmpt? -86.88 5.07 38.7 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -177.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.528 ' HB2' HG21 ' A' ' 81' ' ' THR . 39.1 m-20 -152.97 19.93 0.58 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.745 -179.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.824 ' CB ' HD12 ' A' ' 71' ' ' LEU . 0.8 OUTLIER -84.84 -31.17 23.95 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.645 179.156 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.504 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 84.6 t60 -178.44 -52.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.541 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.23 -87.0 0.3 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.94 -0.647 . . . . 0.0 111.827 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -136.15 -145.52 5.07 Favored Glycine 0 N--CA 1.442 -0.931 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.605 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.436 ' HD2' ' CE1' ' A' ' 20' ' ' HIS . 1.2 ttpt -94.1 -20.88 19.5 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.603 0.24 . . . . 0.0 111.339 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -52.29 -53.85 38.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.557 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -79.41 -27.21 41.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.317 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.091 HD12 ' CE1' ' A' ' 20' ' ' HIS . 2.1 tm? -75.24 -29.28 60.18 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -49.05 -38.29 23.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.653 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -75.91 -23.57 55.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.715 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.911 ' CG1' HG13 ' A' ' 67' ' ' VAL . 0.9 OUTLIER -87.26 -58.16 3.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.831 179.764 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.62 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -59.32 -24.23 63.14 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.898 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.433 ' O ' ' HB2' ' A' ' 39' ' ' ASN . 1.0 OUTLIER -56.67 -44.3 81.28 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 177.816 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.821 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.8 m-70 -57.82 -49.61 76.08 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 177.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.967 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -57.4 -66.64 0.43 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.591 178.536 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.68 ' O ' HG22 ' A' ' 41' ' ' ILE . 0.3 OUTLIER -46.46 -41.99 14.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.684 -179.59 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 35' ' ' ASN . 2.1 t-20 -68.52 -26.02 65.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.875 0.369 . . . . 0.0 110.615 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 1.059 HG12 HD11 ' A' ' 44' ' ' ILE . 53.8 t -77.32 -37.71 25.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.525 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.686 HD11 ' HB3' ' A' ' 9' ' ' LEU . 4.8 tp -48.17 -37.31 7.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 120.995 0.426 . . . . 0.0 110.664 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -75.67 -41.21 54.47 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.699 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.411 ' HB3' ' HE3' ' A' ' 60' ' ' MET . 4.0 m-20 -60.53 -30.23 69.62 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 1.059 HD11 HG12 ' A' ' 40' ' ' VAL . 4.0 mt -86.54 -41.93 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.886 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 25.8 m170 -62.44 -43.97 97.54 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.273 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -73.89 -11.22 60.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.076 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.48 ' CD1' ' C ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -85.43 -42.03 14.87 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.76 179.781 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.537 ' CE ' HD12 ' A' ' 9' ' ' LEU . 1.6 tpp -45.73 -27.74 0.88 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.925 -179.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.86 19.96 10.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.788 0.328 . . . . 0.0 111.763 -179.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 75.85 33.16 51.79 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.644 -0.788 . . . . 0.0 113.121 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -95.19 40.24 2.71 Favored Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 109.961 -1.255 . . . . 0.0 109.961 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 123.11 21.29 2.59 Favored Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 114.503 -0.849 . . . . 0.0 111.015 -178.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.439 ' HA ' ' CD1' ' A' ' 47' ' ' PHE . 33.4 p -61.36 166.09 4.17 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 121.088 0.471 . . . . 0.0 111.433 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.671 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . 51.36 51.38 37.1 Favored Glycine 0 N--CA 1.452 -0.284 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.909 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.402 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . 171.61 -33.83 0.14 Allowed Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.288 -0.958 . . . . 0.0 113.192 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.581 ' HD3' ' N ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -88.41 -26.19 22.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.874 0.337 . . . . 0.0 111.689 -179.491 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.581 ' N ' ' HD3' ' A' ' 56' ' ' LYS . 19.7 tp -70.12 -8.14 47.2 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.575 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 55' ' ' GLY . 17.3 pt20 -86.39 -49.88 7.31 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.924 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.4 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 3.8 mt-10 -86.88 -34.1 19.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.447 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.496 ' HG3' HG13 ' A' ' 40' ' ' VAL . 8.7 tpp -74.22 -29.51 61.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.551 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.508 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 5.9 ttm -56.06 -50.74 70.12 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.978 0.418 . . . . 0.0 110.138 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -59.52 -20.87 58.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.824 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.631 ' HB3' HG21 ' A' ' 40' ' ' VAL . 0.7 OUTLIER -71.83 -33.2 68.28 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.043 179.935 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.474 ' CE2' ' HG3' ' A' ' 61' ' ' MET . 1.1 p90 -84.08 -25.81 29.5 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 120.983 0.42 . . . . 0.0 110.068 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.58 -35.33 27.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.256 178.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.08 -32.44 61.95 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.445 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.967 HG21 ' HB2' ' A' ' 37' ' ' LEU . 96.3 t -58.84 -38.74 74.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.005 179.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.996 HD21 HG13 ' A' ' 85' ' ' ILE . 0.7 OUTLIER -78.62 -4.33 48.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.233 178.453 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -76.41 -56.74 4.35 Favored 'General case' 0 CA--C 1.521 -0.14 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.604 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 3.1 tp10 -54.02 -36.62 63.2 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.99 0.9 . . . . 0.0 108.674 177.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.925 HD21 HG13 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -74.73 -69.64 0.45 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 113.553 -1.658 . . . . 0.0 112.168 -179.223 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.41 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 42.2 t-20 -50.16 -26.14 4.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.633 -179.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -87.27 7.82 26.86 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.428 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.499 ' O ' ' N ' ' A' ' 76' ' ' GLN . 5.7 m-70 -155.38 34.51 0.37 Allowed 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.582 ' CD2' HG21 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -51.23 90.34 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.105 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.029 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.499 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -65.64 68.3 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.536 -177.965 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 57.45 29.67 60.87 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.646 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.553 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -136.86 46.14 1.04 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.476 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.46 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.7 OUTLIER -52.67 -38.99 61.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.751 0.31 . . . . 0.0 111.224 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -49.58 -32.45 12.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.568 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.668 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -69.03 -74.16 0.13 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.925 HG13 HD21 ' A' ' 71' ' ' LEU . 22.6 t -49.46 -39.19 13.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.914 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.453 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.3 OUTLIER -49.02 -41.51 34.97 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 179.234 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -76.43 -28.92 56.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.694 178.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.996 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.57 -33.41 7.68 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.346 -179.579 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -74.43 -43.06 57.91 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 179.115 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -62.49 -29.33 70.46 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.716 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.8 m-80 -82.92 -57.05 3.47 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.443 179.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.972 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -63.51 -51.15 74.15 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.347 -179.675 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.493 ' N ' HG22 ' A' ' 89' ' ' ILE . 5.8 mmtp -59.15 -27.53 65.73 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.119 -0.632 . . . . 0.0 109.782 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -90.72 -2.22 57.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.146 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.716 HD13 ' O ' ' A' ' 88' ' ' ASN . 0.9 OUTLIER -78.44 -46.62 25.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.339 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.639 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -52.5 -27.56 16.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.41 178.927 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.639 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.2 OUTLIER -65.16 -64.06 0.95 Allowed 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.661 -179.586 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.462 ' O ' HD21 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -61.36 -11.51 10.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.993 178.328 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.589 HD11 HD21 ' A' ' 9' ' ' LEU . 24.7 mt -89.34 -65.39 1.02 Allowed 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 120.949 0.404 . . . . 0.0 110.587 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.451 ' N ' HD21 ' A' ' 57' ' ' LEU . 25.4 tt0 -64.16 -14.24 53.78 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.176 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 11.2 tt0 -83.33 -24.87 31.94 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.524 179.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 1.089 HD13 HD23 ' A' ' 5' ' ' LEU . 31.4 tp -70.82 -61.48 1.75 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.744 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.671 HG11 ' HA2' ' A' ' 54' ' ' GLY . 22.7 t -65.56 -31.58 54.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.137 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -100.46 32.8 2.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.99 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.915 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.7 ttm . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.812 0.339 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.413 ' CE2' ' OXT' ' A' ' 102' ' ' ARG . 96.1 m-85 -96.96 40.88 1.13 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.823 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -118.54 -24.2 3.22 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.863 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.7 tptm -63.8 -15.62 59.2 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.705 0.252 . . . . 0.0 111.232 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.831 HD11 ' HB3' ' A' ' 95' ' ' HIS . 0.1 OUTLIER -54.17 -22.15 10.59 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.861 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.48 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 20.5 p-10 -54.41 -45.24 72.92 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.649 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.16 -33.63 19.68 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.296 0.57 . . . . 0.0 109.539 178.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.587 ' C ' HD13 ' A' ' 8' ' ' LEU . 1.7 tm? -87.85 -30.46 20.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.01 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.938 HD12 ' HE3' ' A' ' 48' ' ' MET . 0.4 OUTLIER -65.89 -38.09 87.84 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.082 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -50.51 -40.76 52.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.229 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -47.07 -42.17 18.28 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.075 0.464 . . . . 0.0 110.485 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.015 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -57.31 -61.14 2.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.268 179.234 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.737 ' H ' HD23 ' A' ' 12' ' ' LEU . 1.1 tm0? -50.63 -38.49 46.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.054 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.81 -31.04 61.6 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.832 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -64.97 -29.85 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.735 178.85 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.679 HD21 HD11 ' A' ' 89' ' ' ILE . 3.2 mm? -63.84 -28.43 69.85 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.092 178.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -48.95 -40.97 32.41 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-O 121.155 0.502 . . . . 0.0 110.041 179.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.779 ' HB3' HG23 ' A' ' 81' ' ' THR . 8.7 m120 -72.41 -45.67 58.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.79 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.928 HD12 HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -43.93 -49.25 8.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.592 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.735 ' CD2' HD12 ' A' ' 30' ' ' LEU . 43.9 m80 -45.79 -39.38 8.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.098 -179.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.468 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 4.3 mmpt? -91.17 6.62 44.36 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -177.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.506 ' O ' HD13 ' A' ' 75' ' ' LEU . 3.0 m-80 -146.5 10.84 1.11 Allowed 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.497 -0.481 . . . . 0.0 112.279 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.922 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -82.07 -35.31 28.8 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.789 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.477 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 85.7 t60 -179.13 -51.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.009 0.433 . . . . 0.0 110.726 179.518 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -134.59 -93.72 0.47 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.903 -0.665 . . . . 0.0 111.747 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -129.13 -148.03 6.5 Favored Glycine 0 N--CA 1.44 -1.081 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.443 ' HD3' ' CE1' ' A' ' 31' ' ' HIS . 7.9 ttmt -94.35 -15.72 24.13 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.626 0.25 . . . . 0.0 111.476 179.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -55.91 -52.28 64.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.862 0.363 . . . . 0.0 111.027 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -81.97 -28.57 32.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.598 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.922 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.4 tm? -70.59 -32.24 69.54 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 178.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.443 ' CE1' ' HD3' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -44.51 -55.12 5.36 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.051 179.904 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -20.41 62.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.117 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.98 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.0 OUTLIER -90.01 -60.25 2.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.716 179.799 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.577 ' H ' HD13 ' A' ' 30' ' ' LEU . 1.0 OUTLIER -62.88 -25.62 68.39 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.182 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.412 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 10.8 t-20 -54.7 -37.72 66.15 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 177.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.893 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -66.15 -49.61 66.81 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.139 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.952 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -53.09 -67.74 0.23 Allowed 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.824 178.595 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.486 ' O ' HG22 ' A' ' 41' ' ' ILE . 24.2 tt0 -46.25 -43.18 15.32 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.262 -179.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -63.73 -24.09 67.63 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.761 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 36' ' ' HIS . 50.8 t -70.55 -56.02 12.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.695 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.775 HD12 HD22 ' A' ' 9' ' ' LEU . 0.1 OUTLIER -44.27 -39.75 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.965 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 3.3 pt-20 -71.15 -32.37 68.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.342 . . . . 0.0 110.404 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.547 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.4 OUTLIER -79.04 -27.04 43.12 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.766 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.702 ' CD1' HG12 ' A' ' 40' ' ' VAL . 20.6 mt -86.92 -26.11 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.109 178.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.466 ' NE2' HG13 ' A' ' 41' ' ' ILE . 20.3 m170 -77.88 -57.5 3.77 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.865 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.28 -25.66 67.25 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.072 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.547 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.9 m-85 -88.98 -28.13 20.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.665 179.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.938 ' HE3' HD12 ' A' ' 9' ' ' LEU . 1.9 ttt -49.46 -28.56 5.43 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.583 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -29.62 43.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.063 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 129.85 -6.3 6.13 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.905 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.45 -29.78 7.66 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.144 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.438 ' HA3' ' CE2' ' A' ' 47' ' ' PHE . . . -157.73 23.0 0.41 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.287 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.5 p -59.97 165.5 3.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.815 0.341 . . . . 0.0 110.543 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.664 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . 66.46 51.13 44.97 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.531 -0.842 . . . . 0.0 111.995 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 161.19 -24.07 0.24 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.42 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.486 ' HZ3' HD13 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -84.27 -43.19 15.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.682 0.277 . . . . 0.0 111.134 179.854 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.533 ' O ' ' CB ' ' A' ' 61' ' ' MET . 14.3 tp -65.21 -9.66 25.3 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -86.44 -50.34 6.95 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.793 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -87.33 -31.73 20.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.894 0.378 . . . . 0.0 110.594 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.76 ' HG3' HG13 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -78.19 -28.01 48.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.089 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.533 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.5 OUTLIER -59.32 -41.45 89.09 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.071 179.656 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -71.15 -15.73 62.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.083 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.439 ' HG2' HG22 ' A' ' 40' ' ' VAL . 0.9 OUTLIER -80.96 -25.93 36.99 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.273 -179.81 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.61 ' HB3' HG11 ' A' ' 40' ' ' VAL . 1.2 p90 -86.91 -33.82 19.59 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 121.03 0.443 . . . . 0.0 110.039 179.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.455 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 10.5 tt0 -79.14 -35.67 41.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.731 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.6 tp60 -54.06 -33.5 57.63 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.969 0.414 . . . . 0.0 110.477 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.98 HG13 ' CG1' ' A' ' 33' ' ' VAL . 71.8 t -59.41 -39.5 79.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.217 179.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 1.031 HD21 HG13 ' A' ' 85' ' ' ILE . 0.5 OUTLIER -76.19 -5.67 47.82 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.394 178.68 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -75.68 -56.87 4.27 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.487 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 0.5 OUTLIER -53.57 -38.12 63.58 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 122.143 0.973 . . . . 0.0 108.674 177.594 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.958 HD21 HG13 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -72.41 -67.36 0.56 Allowed 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 113.434 -1.712 . . . . 0.0 111.848 -179.345 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.422 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 65.9 t30 -51.04 -26.08 5.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.508 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -88.11 9.38 22.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.367 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.502 ' O ' ' N ' ' A' ' 76' ' ' GLN . 73.0 m-70 -154.97 32.31 0.4 Allowed 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 111.768 0.284 . . . . 0.0 111.768 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.568 HD21 ' HB ' ' A' ' 82' ' ' VAL . 0.2 OUTLIER -52.67 88.31 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.086 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.502 ' N ' ' O ' ' A' ' 74' ' ' HIS . 1.2 mm-40 -67.97 69.7 0.13 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.441 . . . . 0.0 111.171 -178.281 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 60.88 21.57 58.88 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.584 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.559 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -121.94 39.41 2.33 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.312 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.467 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -49.26 -40.65 35.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.866 0.365 . . . . 0.0 111.469 -179.767 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 1.9 m170 -55.43 -33.9 63.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.58 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.779 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.3 m -67.45 -74.41 0.12 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.958 HG13 HD21 ' A' ' 71' ' ' LEU . 39.7 t -51.12 -40.73 22.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.083 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.469 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 56.6 t-80 -49.84 -40.88 43.75 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -76.54 -28.35 56.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.635 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 1.031 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.3 -33.13 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.962 -179.589 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.506 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.2 OUTLIER -74.38 -46.53 39.82 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.851 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.35 -30.28 66.61 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.796 ' O ' HD13 ' A' ' 92' ' ' ILE . 2.5 m-80 -82.75 -68.15 0.73 Allowed 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.335 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 1.015 ' CG1' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -50.53 -45.76 26.47 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.473 -179.761 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.414 ' N ' HG22 ' A' ' 89' ' ' ILE . 1.2 mmmm -62.53 -30.21 71.12 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.734 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -90.75 -2.32 57.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.278 178.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.796 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -78.68 -35.63 18.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.634 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -65.37 -30.81 71.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.506 179.177 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.634 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.1 OUTLIER -59.88 -57.09 14.38 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.318 -179.207 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.831 ' HB3' HD11 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -69.81 -9.96 56.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.387 178.87 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.676 HD21 ' HG ' ' A' ' 9' ' ' LEU . 35.5 mt -89.43 -54.24 4.18 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.456 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.405 ' HG2' HD23 ' A' ' 57' ' ' LEU . 1.6 mt-10 -62.97 -13.15 31.36 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 177.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.43 ' O ' ' CB ' ' A' ' 102' ' ' ARG . 0.1 OUTLIER -80.75 -1.3 42.22 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.836 179.383 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.668 HD21 ' HB2' ' A' ' 5' ' ' LEU . 4.1 mt -96.1 -67.2 0.86 Allowed 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.127 0.489 . . . . 0.0 110.597 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.664 HG11 ' HA2' ' A' ' 54' ' ' GLY . 41.3 t -59.78 -27.45 38.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.946 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 97' ' ' GLU . 10.9 t-80 -86.91 -33.08 19.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.107 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.43 ' CB ' ' O ' ' A' ' 98' ' ' GLU . 38.2 ttp180 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.952 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 ttt . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.843 0.354 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.426 ' CE1' ' HG3' ' A' ' 102' ' ' ARG . 66.6 m-85 -91.6 112.54 24.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.885 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.48 ' HA2' ' HG3' ' A' ' 48' ' ' MET . . . -175.13 -36.65 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.609 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.7 tptt -55.87 -19.55 12.25 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.54 0.17 . . . . 0.0 111.241 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.863 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -49.65 -23.51 1.76 Allowed 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.35 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.422 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 12.2 p30 -58.42 -42.74 87.9 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.742 178.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -48.81 -30.6 5.91 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.273 0.558 . . . . 0.0 109.752 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.835 ' O ' HD13 ' A' ' 8' ' ' LEU . 2.2 tm? -83.64 -35.58 24.49 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.933 178.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.678 ' HB3' HD11 ' A' ' 41' ' ' ILE . 7.9 mt -62.23 -40.95 97.87 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.82 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -49.0 -44.26 40.99 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.683 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.407 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 0.9 OUTLIER -49.71 -45.74 49.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.101 -179.821 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.954 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -56.54 -61.64 2.28 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.717 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.574 ' H ' HD23 ' A' ' 12' ' ' LEU . 4.0 tm0? -51.53 -39.3 57.44 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.481 -179.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -75.53 -28.77 59.2 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.856 HG13 ' HB ' ' A' ' 85' ' ' ILE . 0.3 OUTLIER -67.69 -27.42 38.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.976 179.031 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.711 ' CD1' HD13 ' A' ' 19' ' ' LEU . 2.9 mm? -64.8 -29.7 70.68 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.722 178.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.433 ' HA ' ' ND1' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -47.51 -39.95 17.42 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.21 0.529 . . . . 0.0 110.075 179.277 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.859 ' HB3' HG23 ' A' ' 81' ' ' THR . 2.1 m120 -73.82 -45.49 51.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.072 178.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.858 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -46.9 -42.95 18.39 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.618 -179.836 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.761 ' CD2' HD12 ' A' ' 30' ' ' LEU . 40.5 m80 -48.81 -40.82 30.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.869 0.366 . . . . 0.0 111.734 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.5 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 3.9 mmpt? -89.2 5.78 43.17 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.697 ' O ' HD13 ' A' ' 75' ' ' LEU . 3.8 m120 -142.03 5.21 1.7 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.468 -0.493 . . . . 0.0 112.274 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.912 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -81.07 -51.91 7.97 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.738 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.518 ' HB3' ' CZ2' ' A' ' 23' ' ' TRP . 8.7 t-160 179.56 58.67 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.939 0.4 . . . . 0.0 110.876 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 116.72 -104.05 1.18 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.061 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -128.81 -146.24 6.14 Favored Glycine 0 N--CA 1.443 -0.9 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.961 179.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.49 ' HG3' ' CD2' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -94.18 -13.28 26.84 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -49.14 -62.66 1.41 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.8 m-80 -77.32 -27.83 53.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.695 0.283 . . . . 0.0 110.728 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.912 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.3 tm? -68.37 -31.18 70.37 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.449 ' N ' ' O ' ' A' ' 27' ' ' LYS . 3.8 t-80 -45.25 -58.69 3.1 Favored 'General case' 0 CA--C 1.523 -0.091 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.803 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.4 -21.99 52.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.015 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.96 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.5 t -87.09 -64.93 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.691 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.616 ' H ' HD13 ' A' ' 30' ' ' LEU . 1.1 t70 -59.46 -21.67 60.41 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -59.8 -39.84 86.35 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.982 ' O ' HG23 ' A' ' 40' ' ' VAL . 1.3 m-70 -63.51 -52.57 60.64 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 177.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.949 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -54.59 -67.31 0.28 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.684 178.328 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.807 ' O ' HG22 ' A' ' 41' ' ' ILE . 1.8 tt0 -47.41 -43.49 23.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.182 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -66.86 -25.2 66.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.546 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.982 HG23 ' O ' ' A' ' 36' ' ' HIS . 81.3 t -75.21 -39.86 43.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.807 HG22 ' O ' ' A' ' 38' ' ' GLN . 6.9 tp -43.23 -35.45 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.184 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -75.86 -40.82 53.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.192 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.792 ' OD2' HG13 ' A' ' 40' ' ' VAL . 4.2 p30 -62.14 -30.79 71.28 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.583 HG13 ' O ' ' A' ' 40' ' ' VAL . 2.3 mt -86.84 -40.55 14.14 Favored 'Isoleucine or valine' 0 C--N 1.337 0.051 0 CA-C-O 121.043 0.449 . . . . 0.0 109.972 178.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.406 ' NE2' HG13 ' A' ' 41' ' ' ILE . 18.6 m170 -59.39 -40.97 88.26 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.423 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -82.59 -10.02 59.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.803 178.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.533 ' HB3' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -87.8 -36.7 17.13 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.161 -179.847 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.48 ' HG3' ' HA2' ' A' ' 3' ' ' GLY . 10.2 ptt? -49.06 -28.8 4.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.296 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -79.07 -21.48 46.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.469 -179.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 117.29 -6.22 17.05 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.558 -0.829 . . . . 0.0 113.04 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.43 -28.62 6.66 Favored Glycine 0 C--N 1.334 0.422 0 C-N-CA 120.571 -0.823 . . . . 0.0 112.078 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -156.09 27.67 0.57 Allowed Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.521 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 25.8 p -74.0 148.37 42.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.025 0.44 . . . . 0.0 111.381 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 74.42 52.96 7.02 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 115.703 -0.681 . . . . 0.0 112.762 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 162.74 -35.03 0.33 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.386 -0.912 . . . . 0.0 113.274 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.48 ' HE2' ' O ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -88.35 -38.96 14.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.95 0.375 . . . . 0.0 111.759 -179.478 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.557 ' O ' ' HB3' ' A' ' 61' ' ' MET . 47.1 tp -60.51 -10.91 5.65 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.51 ' O ' ' HG3' ' A' ' 61' ' ' MET . 3.8 pt20 -85.74 -49.33 8.03 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.837 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.41 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 3.7 mt-10 -87.58 -28.94 21.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.95 0.405 . . . . 0.0 110.328 179.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.402 ' CB ' ' O ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -77.18 -33.92 56.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.91 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.557 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -53.64 -41.43 66.73 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.106 0.479 . . . . 0.0 110.389 179.748 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 19.1 mmtt -57.75 -24.21 55.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.939 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.651 ' HB3' HG21 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -68.75 -42.91 76.88 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.424 -179.785 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.853 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.7 p90 -69.92 -29.66 66.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.923 0.392 . . . . 0.0 110.421 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -82.41 -30.58 30.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.41 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.59 -41.25 73.1 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.605 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.96 HG13 ' CG1' ' A' ' 33' ' ' VAL . 14.6 t -56.15 -50.09 72.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.027 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 1.016 HD21 HG13 ' A' ' 85' ' ' ILE . 0.4 OUTLIER -63.13 -16.38 59.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.618 179.13 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -65.62 -61.19 2.23 Favored 'General case' 0 C--O 1.231 0.097 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.476 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -51.06 -36.59 40.74 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.906 0.86 . . . . 0.0 109.401 178.175 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.895 HD21 HG13 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -70.68 -69.11 0.38 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 113.745 -1.57 . . . . 0.0 112.336 -178.884 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.418 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 2.6 m-20 -50.25 -26.26 4.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.56 -179.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -88.69 9.8 23.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.506 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.625 ' O ' ' N ' ' A' ' 76' ' ' GLN . 79.0 m-70 -153.82 28.72 0.47 Allowed 'General case' 0 CA--C 1.52 -0.18 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.697 HD13 ' O ' ' A' ' 22' ' ' ASN . 0.3 OUTLIER -49.38 85.3 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.016 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.625 ' N ' ' O ' ' A' ' 74' ' ' HIS . 16.9 mm-40 -82.05 -37.74 26.0 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.052 -177.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -83.75 -58.07 2.32 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.223 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 174.53 121.82 0.65 Allowed Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.231 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.572 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 1.3 mtmt -42.75 -30.41 0.38 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -43.18 -35.02 1.25 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.76 0.314 . . . . 0.0 111.417 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.859 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.4 m -69.93 -74.23 0.14 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.895 HG13 HD21 ' A' ' 71' ' ' LEU . 27.3 t -48.58 -38.44 9.45 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.403 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.098 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.472 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 1.3 t-80 -50.77 -41.29 56.65 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -76.2 -28.14 57.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.624 178.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 1.016 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.67 -33.6 7.79 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.14 -179.748 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.554 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -75.3 -45.42 39.9 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.801 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.466 ' O ' ' HB2' ' A' ' 91' ' ' GLU . 1.5 mp0 -59.62 -29.66 68.15 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 178.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.732 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.9 m-80 -82.96 -63.58 1.34 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.438 179.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 1.003 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -55.03 -43.77 71.12 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.22 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.468 -179.73 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -63.37 -29.32 70.65 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.133 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 87' ' ' GLN . 0.4 OUTLIER -90.39 -6.81 54.53 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.102 178.522 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.732 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -72.9 -42.25 60.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.638 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -58.47 -27.65 64.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.365 178.763 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.638 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.0 OUTLIER -62.47 -63.88 1.09 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.169 -179.222 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.653 ' HB3' HD11 ' A' ' 5' ' ' LEU . 11.8 m80 -64.21 -10.5 23.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.144 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.596 HD11 HD21 ' A' ' 9' ' ' LEU . 31.3 mt -88.52 -55.57 3.67 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.086 0.47 . . . . 0.0 110.061 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.416 ' N ' HD21 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -72.9 -7.88 53.0 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.932 178.7 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -90.96 -25.26 19.84 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.758 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.863 HD13 HD23 ' A' ' 5' ' ' LEU . 15.9 tp -70.17 -52.77 20.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.157 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 33.4 t -69.64 -27.99 35.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.423 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -77.51 -38.58 48.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.761 0.315 . . . . 0.0 110.975 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.426 ' HG3' ' CE1' ' A' ' 2' ' ' TYR . 12.6 ptp180 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.953 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpp? . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.912 0.387 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -131.49 140.42 49.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.879 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 130.35 -40.71 1.63 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.181 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.77 -16.67 61.77 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 120.567 0.222 . . . . 0.0 110.589 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 1.043 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -51.39 -23.92 4.31 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 177.878 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.512 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 23.4 t-20 -63.64 -46.51 85.36 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.612 178.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -48.62 -35.12 12.96 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.625 HD13 ' O ' ' A' ' 8' ' ' LEU . 2.5 tm? -88.07 -29.13 20.87 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.144 178.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.814 ' HG ' HD21 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -70.06 -33.03 71.42 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.056 0.455 . . . . 0.0 110.292 179.829 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -54.54 -40.68 68.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.235 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.459 ' HA ' ' HG2' ' A' ' 14' ' ' GLU . 0.4 OUTLIER -48.32 -43.77 33.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.931 0.396 . . . . 0.0 110.848 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.992 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -57.79 -60.53 3.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.768 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.638 ' H ' HD23 ' A' ' 12' ' ' LEU . 4.8 tp60 -51.47 -41.36 60.84 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.555 -179.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.459 ' HG2' ' HA ' ' A' ' 11' ' ' ASP . 10.8 pt-20 -74.21 -22.02 59.55 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.846 0.355 . . . . 0.0 110.203 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.865 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -74.21 -27.14 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.254 179.249 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.818 HD21 HD11 ' A' ' 89' ' ' ILE . 3.1 mm? -65.54 -34.62 78.68 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.356 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.82 -42.99 8.35 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 121.104 0.478 . . . . 0.0 110.247 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.668 ' HB3' HG23 ' A' ' 81' ' ' THR . 0.3 OUTLIER -68.35 -42.86 78.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.477 0.656 . . . . 0.0 109.263 178.595 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.875 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -53.66 -37.05 62.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.814 179.683 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.989 ' CE1' HD12 ' A' ' 30' ' ' LEU . 49.3 m-70 -54.04 -34.48 60.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.386 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.537 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.4 mmpt? -94.29 3.39 55.28 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -138.91 -1.43 1.79 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.94 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -72.88 -56.02 5.79 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.21 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.588 ' HB3' ' CH2' ' A' ' 23' ' ' TRP . 8.2 t-160 179.04 47.18 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.843 178.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 51.26 172.57 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.106 -0.569 . . . . 0.0 113.205 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.6 78.92 0.13 Allowed Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 121.012 -0.614 . . . . 0.0 112.283 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -27.05 5.52 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.95 -30.65 66.14 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.85 178.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -78.81 -40.51 32.77 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.989 HD12 ' CE1' ' A' ' 20' ' ' HIS . 1.1 tm? -65.97 -36.38 83.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.383 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.43 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.3 OUTLIER -46.48 -43.43 16.71 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.239 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.5 -21.3 55.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.467 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.867 HG11 HD22 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -88.3 -46.36 15.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.11 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.515 ' HB2' HD11 ' A' ' 30' ' ' LEU . 2.6 t0 -74.58 -34.33 62.86 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 179.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 2.3 t30 -53.28 -29.17 31.81 Favored 'General case' 0 C--N 1.334 -0.077 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.814 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -57.05 -52.95 63.22 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.806 178.815 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.805 ' CD1' HD21 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -77.1 -32.71 56.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.826 178.825 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.592 ' O ' HG22 ' A' ' 41' ' ' ILE . 2.2 tm0? -54.96 -37.47 66.53 Favored 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -83.42 -18.3 39.18 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.952 178.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.814 HG23 ' O ' ' A' ' 36' ' ' HIS . 55.3 t -75.97 -40.81 38.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.125 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.592 HG22 ' O ' ' A' ' 38' ' ' GLN . 2.3 tp -45.53 -35.9 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.278 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.568 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 0.4 OUTLIER -75.56 -28.03 58.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.561 179.546 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 1.3 m-20 -79.38 -26.32 42.01 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.737 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.636 HD11 HG12 ' A' ' 40' ' ' VAL . 2.8 mt -86.17 -57.69 4.08 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.856 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.568 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -58.76 -27.31 64.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.04 -179.948 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.503 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 27.6 t0 -86.67 -26.36 24.35 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.568 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.9 m-85 -83.74 -52.49 6.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.273 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.509 ' SD ' HG22 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -51.97 -21.64 3.23 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.399 -179.411 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.08 16.09 10.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.348 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 102.41 31.99 5.04 Favored Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.89 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.41 ' CA ' ' HA ' ' A' ' 47' ' ' PHE . . . -111.22 24.98 14.71 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.614 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.72 25.74 9.63 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.643 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -20.02 55.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.636 0.255 . . . . 0.0 111.235 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.624 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -77.02 70.86 2.28 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.982 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.47 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . 133.64 -7.33 4.91 Favored Glycine 0 CA--C 1.518 0.223 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.953 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.926 ' NZ ' HD22 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -88.73 -37.48 15.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.669 0.271 . . . . 0.0 111.213 -179.89 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.926 HD22 ' NZ ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -63.59 -11.98 29.29 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.248 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 1.7 pp0? -86.03 -49.92 7.44 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.551 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -86.92 -30.46 21.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.753 0.311 . . . . 0.0 110.576 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.602 ' HG2' HG13 ' A' ' 40' ' ' VAL . 0.6 OUTLIER -77.88 -31.06 51.13 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.753 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.482 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -55.17 -33.82 63.3 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.896 0.379 . . . . 0.0 110.489 179.771 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 66' ' ' GLN . 31.3 tttt -67.39 -26.15 66.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.092 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.746 ' HB3' HG21 ' A' ' 40' ' ' VAL . 2.4 tp10 -70.51 -37.25 74.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.692 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.483 ' HA ' ' HB2' ' A' ' 37' ' ' LEU . 0.3 OUTLIER -85.09 -27.8 26.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.939 0.4 . . . . 0.0 110.438 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -82.45 -29.9 30.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.231 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.407 ' HB2' ' O ' ' A' ' 62' ' ' LYS . 1.1 tm0? -62.7 -36.09 81.83 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.597 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.818 HG22 ' O ' ' A' ' 33' ' ' VAL . 72.1 t -52.18 -39.97 28.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.7 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 1.06 HD21 HG13 ' A' ' 85' ' ' ILE . 1.0 OUTLIER -73.67 -5.3 39.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.004 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' A' ' 66' ' ' GLN . 2.2 m-20 -78.08 -56.38 4.52 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.507 ' CB ' HG21 ' A' ' 33' ' ' VAL . 4.8 tp10 -52.43 -32.5 39.66 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 122.029 0.919 . . . . 0.0 108.788 177.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.875 HD13 ' CG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -79.13 -64.98 1.06 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.883 -179.106 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.425 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 65.2 t30 -50.46 -24.73 3.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.748 -179.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -88.74 3.89 49.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.817 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.497 ' O ' ' N ' ' A' ' 76' ' ' GLN . 91.3 m-70 -147.19 26.97 1.06 Allowed 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.577 HD11 HG23 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -49.5 91.95 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.027 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 74' ' ' HIS . 13.2 tt0 -64.54 68.23 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.594 -178.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 56.33 29.08 56.19 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.666 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.465 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -138.96 48.92 0.84 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.385 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.536 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -55.42 -36.09 66.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.541 0.21 . . . . 0.0 111.496 -179.764 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -45.26 -32.87 2.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.636 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.668 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -69.69 -74.64 0.13 Allowed 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.849 HG13 HD21 ' A' ' 71' ' ' LEU . 38.3 t -48.83 -38.81 10.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.98 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.473 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -50.26 -41.57 50.63 Favored 'General case' 0 CA--C 1.522 -0.12 0 CA-C-O 121.145 0.498 . . . . 0.0 109.713 179.405 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -76.16 -27.21 56.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.564 178.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 1.06 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.52 -35.76 10.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.074 -179.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -71.24 -44.69 64.83 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.477 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.405 ' NE2' ' HA ' ' A' ' 87' ' ' GLN . 3.8 mm-40 -61.53 -29.05 69.75 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.729 ' O ' HD13 ' A' ' 92' ' ' ILE . 2.1 m-80 -83.01 -64.75 1.11 Allowed 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.222 178.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.992 ' CG1' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -54.12 -50.85 52.01 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.41 -179.745 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.433 ' N ' HG22 ' A' ' 89' ' ' ILE . 7.2 mmmt -59.78 -29.5 68.24 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.007 -0.677 . . . . 0.0 109.725 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -90.83 -3.23 57.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.361 178.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.729 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -78.69 -40.09 23.4 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.633 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -60.01 -26.41 66.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.298 178.886 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.633 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 4.0 t60 -62.35 -65.44 0.69 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.157 -179.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.507 ' HB3' HD11 ' A' ' 5' ' ' LEU . 1.5 m-70 -61.7 -10.71 9.24 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.207 178.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.814 HD21 ' HG ' ' A' ' 9' ' ' LEU . 44.2 mt -89.34 -63.5 1.28 Allowed 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.943 0.401 . . . . 0.0 110.566 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -67.87 -11.77 59.32 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.324 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.421 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 0.9 OUTLIER -89.7 -13.12 37.58 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.879 179.565 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 1.043 HD13 HD23 ' A' ' 5' ' ' LEU . 10.0 tp -82.01 -56.45 3.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.016 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.624 HG11 ' HA2' ' A' ' 54' ' ' GLY . 40.9 t -66.67 -43.77 90.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.499 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -59.86 -28.33 67.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.015 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 32.7 ttt-85 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.859 179.938 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtm . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.838 0.352 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.837 ' HB3' HD11 ' A' ' 99' ' ' LEU . 25.8 m-85 -114.77 111.92 22.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.873 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -133.46 8.88 5.0 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.9 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -87.96 -19.41 27.28 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.744 0.272 . . . . 0.0 110.74 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 1.038 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -54.62 -19.3 5.76 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.728 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -61.15 -44.9 96.59 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.961 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -49.75 -28.08 5.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.045 0.45 . . . . 0.0 110.139 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.714 ' O ' HD22 ' A' ' 8' ' ' LEU . 1.2 tm? -87.64 -28.24 21.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.409 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.519 HD11 HG21 ' A' ' 44' ' ' ILE . 8.7 mt -73.18 -38.6 66.1 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.858 0.361 . . . . 0.0 110.774 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -42.83 -32.85 0.67 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.446 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.0 -52.2 13.52 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.519 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.917 ' O ' HG12 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -50.98 -43.2 60.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.301 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.841 ' N ' HD13 ' A' ' 12' ' ' LEU . 2.0 tt0 -73.51 -38.08 65.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.626 0.251 . . . . 0.0 111.5 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -73.89 -27.58 61.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.08 0.467 . . . . 0.0 110.132 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.917 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.9 OUTLIER -64.83 -24.34 35.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.333 179.163 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.697 HD12 HD13 ' A' ' 19' ' ' LEU . 1.1 mm? -66.49 -37.94 86.17 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.237 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.48 -33.17 1.62 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 121.172 0.511 . . . . 0.0 110.288 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.475 ' HB3' HG23 ' A' ' 81' ' ' THR . 34.3 m-80 -76.79 -45.84 27.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.903 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.971 HD21 HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -47.85 -42.61 26.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.267 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 1.033 ' CE1' HD12 ' A' ' 30' ' ' LEU . 56.3 m-70 -48.43 -42.46 32.32 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.266 -0.424 . . . . 0.0 112.035 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.444 ' HE3' ' C ' ' A' ' 20' ' ' HIS . 0.0 OUTLIER -86.24 5.01 36.33 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -177.248 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.779 ' O ' HD13 ' A' ' 75' ' ' LEU . 9.0 m-80 -146.01 12.63 1.26 Allowed 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.383 -0.527 . . . . 0.0 112.135 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.802 ' CA ' HD12 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -84.78 -33.59 22.97 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.893 179.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.505 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 3.1 t-160 -178.32 -51.18 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.646 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.81 138.73 2.96 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.755 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.44 104.37 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.394 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.4 tttt -53.01 -23.79 8.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.697 0.284 . . . . 0.0 110.775 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -50.91 -31.94 19.15 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.804 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -85.99 -46.91 10.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.496 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.033 HD12 ' CE1' ' A' ' 20' ' ' HIS . 2.0 tm? -60.31 -29.96 69.19 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.404 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 17.0 t-160 -45.69 -56.44 5.25 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.694 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.12 -24.1 62.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.967 0.413 . . . . 0.0 110.779 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.982 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.3 t -84.66 -66.1 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.522 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.623 ' N ' HG12 ' A' ' 33' ' ' VAL . 1.0 OUTLIER -57.87 -23.25 52.2 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.298 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.404 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 16.3 m-20 -56.97 -39.44 74.61 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 177.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.702 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -66.54 -45.63 78.79 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.72 -1.127 . . . . 0.0 108.028 177.366 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.992 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -56.7 -67.13 0.34 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.794 178.612 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.1 tp60 -44.58 -41.79 6.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.056 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -62.21 -29.8 70.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.299 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.847 HG11 ' HB3' ' A' ' 64' ' ' PHE . 97.6 t -62.54 -54.82 28.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.27 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.669 HD11 HD11 ' A' ' 12' ' ' LEU . 17.3 mm -42.5 -46.13 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.938 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 1.1 pt-20 -68.02 -29.86 68.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.884 0.373 . . . . 0.0 110.405 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.546 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.9 OUTLIER -81.39 -25.2 36.45 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.921 -0.582 . . . . 0.0 109.96 178.848 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.572 HG12 ' O ' ' A' ' 40' ' ' VAL . 9.1 mm -87.17 -38.19 11.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.67 179.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.638 ' NE2' HG23 ' A' ' 41' ' ' ILE . 11.6 m170 -78.03 -42.3 32.93 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.633 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -72.04 -27.6 62.81 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.82 0.343 . . . . 0.0 110.47 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.546 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.8 m-85 -88.48 -45.61 9.8 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.485 ' HE1' ' N ' ' A' ' 5' ' ' LEU . 8.1 ptm -46.7 -38.16 9.45 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 120.813 0.34 . . . . 0.0 111.443 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.47 -21.33 66.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.299 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 133.05 24.93 0.69 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.945 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -102.29 35.25 5.09 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.137 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.11 32.57 4.29 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.221 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.72 ' O ' HG11 ' A' ' 100' ' ' VAL . 88.8 p -59.61 -22.48 61.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.687 0.28 . . . . 0.0 111.107 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -91.91 75.1 1.44 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.52 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 145.26 -17.14 1.9 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.619 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.476 ' HE3' ' HB2' ' A' ' 47' ' ' PHE . 2.9 pptp? -88.21 -39.97 14.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.783 0.325 . . . . 0.0 110.915 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' A' ' 96' ' ' LEU . 7.0 tp -65.85 -9.38 28.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.943 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -86.15 -50.08 7.27 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.311 -0.556 . . . . 0.0 110.696 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -87.39 -30.68 20.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.474 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.803 ' HG3' HG13 ' A' ' 40' ' ' VAL . 17.5 tpp -78.14 -33.11 50.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.163 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.528 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 2.4 tmm? -56.12 -41.97 76.12 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 120.189 -0.604 . . . . 0.0 109.843 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.04 -26.69 65.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.918 178.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.463 ' HB3' HG22 ' A' ' 40' ' ' VAL . 0.7 OUTLIER -65.27 -34.4 78.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.049 179.929 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.847 ' HB3' HG11 ' A' ' 40' ' ' VAL . 0.9 OUTLIER -87.38 -26.46 23.31 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.851 0.358 . . . . 0.0 110.606 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -82.64 -32.41 28.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.826 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -57.41 -39.3 75.87 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.202 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.992 HG21 ' HB2' ' A' ' 37' ' ' LEU . 13.0 t -50.19 -44.67 23.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.005 0.431 . . . . 0.0 110.584 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 1.034 HD11 HD13 ' A' ' 89' ' ' ILE . 0.7 OUTLIER -66.25 -13.81 60.96 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.059 179.534 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -67.84 -58.61 4.3 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.494 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 1.9 tp10 -52.81 -37.51 60.04 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 122.0 0.905 . . . . 0.0 109.486 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.871 HD21 HG13 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -72.11 -69.4 0.4 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.652 -1.613 . . . . 0.0 112.565 -178.76 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.12 -26.69 4.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.687 -179.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -90.97 12.4 19.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.244 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.6 ' O ' ' N ' ' A' ' 76' ' ' GLN . 79.4 m-70 -156.33 30.08 0.34 Allowed 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.779 HD13 ' O ' ' A' ' 22' ' ' ASN . 0.2 OUTLIER -50.7 85.25 0.0 OUTLIER 'General case' 0 C--O 1.232 0.157 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.6 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -81.49 -37.54 27.76 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.837 -177.637 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -82.21 -65.85 1.61 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.783 -0.722 . . . . 0.0 113.183 -179.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -179.12 120.12 0.68 Allowed Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.171 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.51 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -40.08 -30.71 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.672 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -44.75 -34.46 2.28 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.848 0.356 . . . . 0.0 111.263 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.699 HG21 ' HB2' ' A' ' 22' ' ' ASN . 1.8 m -68.67 -73.26 0.15 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.871 HG13 HD21 ' A' ' 71' ' ' LEU . 24.3 t -50.24 -38.8 15.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.169 179.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.443 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -48.83 -40.83 30.84 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.401 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -76.2 -29.46 57.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.62 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.98 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.54 -35.4 9.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.36 -179.529 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -73.79 -39.62 64.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.697 0.284 . . . . 0.0 110.248 179.316 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.418 ' O ' ' CB ' ' A' ' 91' ' ' GLU . 2.3 mp0 -67.07 -31.05 71.28 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.497 ' O ' HD13 ' A' ' 92' ' ' ILE . 2.9 m-80 -83.02 -44.24 15.44 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.594 179.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 1.034 HD13 HD11 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -74.1 -54.87 13.88 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.564 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.275 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.569 ' O ' ' CD1' ' A' ' 93' ' ' PHE . 5.9 mmmt -58.56 -28.98 66.02 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.224 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.418 ' CB ' ' O ' ' A' ' 87' ' ' GLN . 2.1 tt0 -90.92 -2.62 57.71 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.561 ' HB ' ' HA ' ' A' ' 89' ' ' ILE . 1.2 tp -78.82 -49.06 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.321 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.649 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.2 OUTLIER -48.29 -26.34 1.96 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.49 179.284 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.649 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 20.6 t-80 -65.1 -66.74 0.5 Allowed 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.816 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.493 ' HB3' HD11 ' A' ' 5' ' ' LEU . 1.0 OUTLIER -60.79 -12.79 11.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.982 -0.553 . . . . 0.0 109.894 178.242 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.602 ' HB3' HD21 ' A' ' 57' ' ' LEU . 22.1 mt -86.04 -64.96 1.07 Allowed 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 120.952 0.406 . . . . 0.0 110.133 179.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.543 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -62.31 -16.7 55.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.789 178.694 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -86.96 2.67 48.66 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.668 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 1.038 HD13 HD23 ' A' ' 5' ' ' LEU . 16.5 tp -100.81 -63.02 1.17 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.969 0.414 . . . . 0.0 110.796 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.72 HG11 ' O ' ' A' ' 53' ' ' SER . 39.8 t -61.86 -28.73 44.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.391 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 38.2 m170 -96.59 33.63 1.8 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.021 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.874 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.0 mtp . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.787 0.327 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.551 ' HB3' HD21 ' A' ' 99' ' ' LEU . 58.9 m-85 -102.92 86.07 2.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.787 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.517 ' O ' ' HE3' ' A' ' 48' ' ' MET . . . -130.42 9.14 5.9 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.777 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 26.6 tptp -95.57 -21.17 18.43 Favored 'General case' 0 CA--C 1.507 -0.674 0 CA-C-O 120.599 0.237 . . . . 0.0 110.637 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.875 HD23 HD13 ' A' ' 99' ' ' LEU . 0.2 OUTLIER -52.04 -23.12 4.77 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.261 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.56 ' HB3' ' HE1' ' A' ' 48' ' ' MET . 26.4 p-10 -60.02 -40.18 88.42 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.569 178.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -49.84 -29.83 8.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.123 0.487 . . . . 0.0 110.027 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.617 ' C ' HD13 ' A' ' 8' ' ' LEU . 2.4 tm? -85.06 -31.25 23.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.247 179.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.999 HD23 HD22 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -68.3 -33.72 74.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.459 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -48.58 -45.51 38.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.324 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.413 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -57.38 -40.67 78.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.776 179.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.999 HD21 HD11 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -59.51 -63.4 1.32 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.747 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.89 ' HA ' HD23 ' A' ' 16' ' ' LEU . 13.0 tt0 -48.61 -41.17 30.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.617 -179.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -71.38 -30.12 65.76 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.101 0.477 . . . . 0.0 109.867 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.975 HG13 HG13 ' A' ' 85' ' ' ILE . 0.4 OUTLIER -66.11 -23.77 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.225 178.9 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 1.066 HD13 HD11 ' A' ' 85' ' ' ILE . 3.8 mm? -67.7 -33.92 75.86 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 177.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.422 ' HA ' ' CE ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -42.05 -42.16 2.8 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 121.189 0.518 . . . . 0.0 109.971 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.758 ' HB3' HG23 ' A' ' 81' ' ' THR . 6.4 m-20 -64.37 -49.11 72.94 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.258 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.892 HD12 HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -48.15 -57.16 6.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.719 -179.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 1.023 ' CE1' HD12 ' A' ' 30' ' ' LEU . 40.8 m-70 -45.25 -27.62 0.67 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.528 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.4 mmpt? -94.29 -20.09 20.1 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -177.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.477 ' O ' HD13 ' A' ' 75' ' ' LEU . 25.3 m120 -122.99 -6.25 8.43 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.997 ' CB ' HD12 ' A' ' 71' ' ' LEU . 0.2 OUTLIER -59.66 -33.28 71.34 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.894 -179.793 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.529 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 78.7 t60 -175.97 -52.65 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.566 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.5 129.35 1.73 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.844 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 71.55 115.09 0.05 OUTLIER Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.354 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -58.66 -18.61 32.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.569 0.224 . . . . 0.0 110.862 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -51.64 -38.1 53.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.627 0.251 . . . . 0.0 110.927 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -83.79 -44.63 14.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.466 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.023 HD12 ' CE1' ' A' ' 20' ' ' HIS . 1.4 tm? -62.1 -27.3 68.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.137 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -48.62 -36.09 15.05 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.627 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.11 -25.07 55.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.975 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.85 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.9 t -87.45 -56.67 5.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.758 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.637 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -59.02 -25.39 63.63 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.475 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -58.73 -40.41 83.69 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 178.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.885 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -63.48 -49.78 72.27 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 177.777 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.042 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -55.47 -67.92 0.24 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.55 178.379 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.3 tm0? -45.68 -42.8 12.03 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.016 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -61.89 -30.69 71.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.326 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.885 HG23 ' O ' ' A' ' 36' ' ' HIS . 61.8 t -64.39 -52.69 52.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.357 179.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.999 HD11 HD21 ' A' ' 12' ' ' LEU . 1.5 mp -42.77 -41.15 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.722 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 43' ' ' ASP . 0.1 OUTLIER -72.77 -28.3 62.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.925 0.393 . . . . 0.0 110.429 179.775 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.519 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 1.1 m-20 -84.03 -28.87 27.35 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.899 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.767 ' CG1' HG12 ' A' ' 40' ' ' VAL . 18.2 mm -86.67 -39.01 12.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.972 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.706 ' CE1' HG23 ' A' ' 41' ' ' ILE . 11.6 m170 -77.94 -36.55 49.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.643 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.409 ' CB ' ' O ' ' A' ' 42' ' ' GLU . 9.8 t70 -76.62 -27.67 55.81 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.67 0.271 . . . . 0.0 110.533 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.519 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 4.1 m-85 -88.35 -43.4 11.54 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.908 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.56 ' HE1' ' HB3' ' A' ' 6' ' ' ASN . 25.5 ptt? -46.6 -29.57 1.88 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.807 0.337 . . . . 0.0 111.457 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -68.61 -28.11 66.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.105 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 141.21 -12.5 2.8 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.875 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -55.13 -22.63 29.61 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.716 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 155.21 55.0 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.281 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.478 ' OG ' HG22 ' A' ' 100' ' ' VAL . 1.2 t -76.17 -20.16 57.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.601 0.239 . . . . 0.0 111.39 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.8 74.03 2.11 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.542 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 145.6 -17.52 1.84 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.637 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.452 ' O ' ' CB ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.18 -43.08 11.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.673 0.273 . . . . 0.0 111.086 179.893 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.51 ' O ' ' CB ' ' A' ' 61' ' ' MET . 44.9 tp -64.34 -10.29 23.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.739 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -85.97 -49.75 7.6 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.853 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -87.14 -30.13 21.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.343 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.642 ' HG3' HG13 ' A' ' 40' ' ' VAL . 3.7 tpt -78.11 -31.39 49.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.861 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.51 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -56.16 -39.01 71.65 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.315 179.714 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.69 -11.57 60.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.144 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.4 ' OE1' ' CD2' ' A' ' 36' ' ' HIS . 3.3 tp10 -84.82 -26.25 27.57 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.46 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.478 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.4 p90 -87.19 -28.81 22.19 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.749 0.309 . . . . 0.0 110.92 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.38 -30.28 30.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.701 179.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -30.7 67.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.825 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 1.042 HG21 ' HB2' ' A' ' 37' ' ' LEU . 24.3 t -57.43 -59.87 2.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.566 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 1.071 HD11 HD13 ' A' ' 89' ' ' ILE . 1.7 mp -61.04 -13.7 18.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.369 178.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -66.82 -52.28 45.63 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.47 ' CG ' ' CZ3' ' A' ' 23' ' ' TRP . 0.2 OUTLIER -58.62 -33.63 70.25 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.76 0.79 . . . . 0.0 108.941 177.69 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.997 HD12 ' CB ' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -63.76 -65.91 0.62 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.265 -1.334 . . . . 0.0 111.851 -179.516 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.522 ' HA ' HD23 ' A' ' 75' ' ' LEU . 15.1 t30 -49.77 -23.91 2.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.708 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -85.24 -3.51 58.84 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 33.4 m-70 -150.92 36.49 0.62 Allowed 'General case' 0 CA--C 1.52 -0.188 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.854 HD21 HG22 ' A' ' 82' ' ' VAL . 0.5 OUTLIER -67.46 85.35 0.17 Allowed 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.343 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -68.03 65.75 0.1 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.97 -178.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.94 54.41 21.73 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.463 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.586 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -154.15 28.67 0.72 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.577 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.428 ' HE3' ' HG ' ' A' ' 75' ' ' LEU . 5.1 mmpt? -43.11 -27.35 0.21 Allowed 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 22.8 p80 -57.5 -41.22 80.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.162 0.506 . . . . 0.0 110.514 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.776 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.4 m -58.65 -52.35 66.06 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.156 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.951 HG13 ' CD2' ' A' ' 71' ' ' LEU . 0.2 OUTLIER -57.95 -60.05 2.67 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.529 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.55 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.47 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 60.8 t-80 -42.88 -40.02 2.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.877 0.37 . . . . 0.0 110.485 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -76.28 -49.05 18.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.177 179.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 1.066 HD11 HD13 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -75.34 -16.74 15.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.723 -179.231 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.618 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -93.08 -44.1 8.55 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 179.196 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 1.1 mp0 -62.69 -23.94 67.39 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 177.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.702 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.3 m-80 -82.73 -59.49 2.49 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 114.491 -1.231 . . . . 0.0 110.07 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 1.071 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -65.07 -49.68 78.24 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.35 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.453 -179.743 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.463 ' N ' HG22 ' A' ' 89' ' ' ILE . 1.3 tptp -58.47 -27.33 64.3 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.494 -0.482 . . . . 0.0 109.941 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -90.7 -4.69 56.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.25 178.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.702 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.0 OUTLIER -78.65 -48.02 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 179.525 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.627 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.2 OUTLIER -48.06 -28.21 2.72 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.456 179.16 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.627 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 34.0 t-80 -62.6 -63.51 1.2 Allowed 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.986 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.542 ' O ' HD21 ' A' ' 5' ' ' LEU . 22.8 m-70 -65.8 -9.17 26.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.182 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 19.3 mt -89.19 -59.87 2.1 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 120.982 0.42 . . . . 0.0 110.149 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.465 ' N ' HD21 ' A' ' 57' ' ' LEU . 87.2 mt-10 -69.0 -12.47 61.71 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.851 178.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -85.97 -22.51 27.32 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.625 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.875 HD13 HD23 ' A' ' 5' ' ' LEU . 27.8 tp -75.29 -60.47 2.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.896 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.478 HG22 ' OG ' ' A' ' 53' ' ' SER . 21.6 t -59.88 -41.09 84.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.389 -179.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.4 -30.56 70.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.919 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.824 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 ttm . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.867 0.365 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.747 ' CG ' HD11 ' A' ' 99' ' ' LEU . 5.0 m-85 -147.72 86.33 1.59 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -116.37 -14.28 7.71 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.725 -0.75 . . . . 0.0 113.024 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.82 -19.78 61.26 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 116.758 0.279 . . . . 0.0 111.193 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 1.041 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -51.93 -23.34 4.85 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.177 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.491 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 16.5 t-20 -65.53 -36.26 83.29 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.766 179.001 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -48.5 -35.79 13.85 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.629 HD13 ' C ' ' A' ' 8' ' ' LEU . 2.4 tm? -88.25 -29.0 20.75 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.093 178.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.746 ' HG ' HD21 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -71.83 -27.01 62.62 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 120.825 0.345 . . . . 0.0 110.619 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -58.55 -46.23 87.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.269 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -46.59 -39.03 10.42 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.985 0.422 . . . . 0.0 111.201 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.978 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -58.53 -61.47 2.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.663 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.73 ' N ' HD23 ' A' ' 12' ' ' LEU . 1.8 tt0 -52.19 -34.9 47.45 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.791 -179.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.33 -29.7 53.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.889 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.865 HG11 ' ND2' ' A' ' 88' ' ' ASN . 0.4 OUTLIER -65.05 -34.52 71.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.834 179.104 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.796 ' CD1' HD13 ' A' ' 19' ' ' LEU . 3.8 mm? -57.13 -36.59 70.88 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.072 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.76 -45.08 4.66 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.127 0.489 . . . . 0.0 110.329 179.075 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.485 ' HB3' HG23 ' A' ' 81' ' ' THR . 59.3 m-80 -67.32 -44.42 79.19 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.324 178.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.879 HD12 HD22 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -52.82 -35.6 57.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.065 179.791 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.908 ' CE1' HD12 ' A' ' 30' ' ' LEU . 26.7 m-70 -55.18 -31.66 61.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.641 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.495 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 6.4 mmpt? -94.38 -4.59 48.18 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -178.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.598 ' HB2' HG21 ' A' ' 81' ' ' THR . 3.5 m-80 -128.06 -13.82 5.04 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.974 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.65 -38.47 84.96 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.573 -179.916 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.495 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 33.3 t60 -175.2 -48.66 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.861 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 143.28 126.6 2.04 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.409 -0.9 . . . . 0.0 112.819 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 88.02 100.13 0.92 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.316 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.38 -26.03 4.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.717 0.294 . . . . 0.0 110.566 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -55.63 -30.02 60.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.507 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -86.97 -35.19 19.0 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.436 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.974 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.2 tm? -71.86 -32.87 67.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.874 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -50.38 -36.24 31.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.846 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.72 -25.96 54.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.551 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.862 ' O ' HG22 ' A' ' 67' ' ' VAL . 2.8 p -89.8 -48.84 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.26 -179.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.57 ' HB2' HD11 ' A' ' 30' ' ' LEU . 2.3 t70 -69.08 -23.75 64.06 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -54.05 -36.14 62.76 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.769 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -62.85 -33.52 75.43 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.309 178.385 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.859 HD11 HD21 ' A' ' 12' ' ' LEU . 0.1 OUTLIER -74.51 -64.25 1.07 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.24 179.184 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.72 ' O ' HG22 ' A' ' 41' ' ' ILE . 3.3 tt0 -46.23 -31.54 2.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.39 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.43 -28.51 59.38 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.919 0.39 . . . . 0.0 110.376 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.769 HG23 ' O ' ' A' ' 36' ' ' HIS . 53.3 t -73.4 -46.42 49.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.659 179.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.72 HG22 ' O ' ' A' ' 38' ' ' GLN . 2.7 tp -45.47 -34.72 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.386 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.61 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 1.4 mt-10 -75.65 -30.95 59.62 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.646 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.528 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.6 OUTLIER -82.8 -25.69 32.48 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.875 178.754 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.581 HG21 HD11 ' A' ' 9' ' ' LEU . 31.0 mm -87.29 -47.53 15.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.678 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.61 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -70.97 -26.9 63.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.865 -178.957 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.504 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 69.3 m-20 -86.65 -40.72 14.84 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 121.07 0.462 . . . . 0.0 110.302 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.528 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 4.3 m-85 -72.3 -40.94 67.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.216 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.473 ' HE3' ' HA ' ' A' ' 45' ' ' HIS . 16.7 ptp -53.29 -26.9 20.23 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.817 0.341 . . . . 0.0 111.072 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -79.71 -1.4 38.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.436 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 120.04 18.38 4.27 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.863 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.403 ' O ' ' CD2' ' A' ' 47' ' ' PHE . . . -95.97 28.1 13.99 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.453 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.27 38.98 3.86 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.448 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.1 p -62.45 -25.68 68.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.773 0.321 . . . . 0.0 111.182 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.42 70.92 3.01 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.531 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.413 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . 150.19 -20.86 1.09 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.798 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.478 ' O ' ' CB ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.44 -46.0 9.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.618 0.246 . . . . 0.0 111.473 -179.814 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.631 HD21 ' HB3' ' A' ' 96' ' ' LEU . 13.7 tp -62.6 -9.28 8.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 61' ' ' MET . 16.9 pt20 -86.2 -50.83 6.69 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.815 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.409 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 17.4 mm-40 -87.66 -28.31 21.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.951 0.405 . . . . 0.0 110.302 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.592 ' CG ' HG13 ' A' ' 40' ' ' VAL . 9.3 tpp -78.23 -33.15 50.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.042 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.554 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 3.8 ptt? -55.44 -38.99 69.73 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.547 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 66' ' ' GLN . 0.3 OUTLIER -65.62 -15.57 62.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.898 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.491 ' HB3' HG21 ' A' ' 40' ' ' VAL . 75.0 tt0 -79.32 -25.4 42.35 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.732 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.555 ' HA ' HD22 ' A' ' 37' ' ' LEU . 2.0 p90 -86.95 -35.39 18.91 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.903 0.382 . . . . 0.0 110.467 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.478 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 0.0 OUTLIER -74.47 -31.2 62.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.545 179.294 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 62' ' ' LYS . 11.6 tt0 -57.91 -33.99 69.35 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.505 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.862 HG22 ' O ' ' A' ' 33' ' ' VAL . 72.0 t -58.09 -47.09 87.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.079 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 1.022 HD11 HD13 ' A' ' 89' ' ' ILE . 1.3 mp -65.31 -14.68 61.33 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.269 178.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -66.37 -62.02 1.69 Allowed 'General case' 0 C--O 1.231 0.094 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HB3' HG21 ' A' ' 33' ' ' VAL . 14.4 tp10 -50.82 -32.1 19.1 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.787 0.804 . . . . 0.0 109.314 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.879 HD22 HD12 ' A' ' 19' ' ' LEU . 0.4 OUTLIER -74.52 -69.41 0.46 Allowed 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 113.979 -1.464 . . . . 0.0 112.232 -178.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.411 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 1.5 t-20 -49.49 -26.3 3.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.702 -179.203 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.64 6.26 28.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.557 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.593 ' O ' ' N ' ' A' ' 76' ' ' GLN . 66.6 m-70 -152.15 32.71 0.53 Allowed 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.746 HD21 HG21 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -54.65 83.28 0.0 OUTLIER 'General case' 0 CA--C 1.521 -0.135 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.789 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.593 ' N ' ' O ' ' A' ' 74' ' ' HIS . 1.0 OUTLIER -83.9 -34.07 24.62 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.947 -177.425 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -83.85 -66.45 1.49 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.615 -0.802 . . . . 0.0 113.062 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -174.35 116.88 0.6 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.115 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.57 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -44.28 -29.78 0.71 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.634 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -45.58 -30.81 1.6 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.838 0.352 . . . . 0.0 111.032 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.598 HG21 ' HB2' ' A' ' 22' ' ' ASN . 1.2 m -69.93 -74.4 0.14 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.851 HG13 HD21 ' A' ' 71' ' ' LEU . 22.2 t -48.92 -40.88 12.8 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.384 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.034 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.471 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -48.97 -41.31 33.78 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.089 0.471 . . . . 0.0 109.737 179.541 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.433 ' O ' ' HB3' ' A' ' 88' ' ' ASN . 0.6 OUTLIER -76.25 -27.58 56.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.696 178.865 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.997 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.61 -36.16 10.48 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.165 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.151 -179.611 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.471 ' CG ' ' HA ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -71.93 -43.68 64.88 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.213 -0.292 . . . . 0.0 110.213 179.433 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -62.41 -29.46 70.51 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.865 ' ND2' HG11 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -82.92 -57.3 3.35 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.305 179.122 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 1.022 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -61.56 -48.23 89.73 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.374 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.97 -179.616 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.454 ' N ' HG22 ' A' ' 89' ' ' ILE . 20.6 tptp -61.46 -28.57 69.38 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 120.291 -0.564 . . . . 0.0 109.494 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -90.73 -2.24 57.82 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.094 178.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.7 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.0 OUTLIER -78.62 -43.27 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.355 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.637 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -54.97 -26.64 37.98 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.149 178.692 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.637 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.1 OUTLIER -62.87 -65.73 0.64 Allowed 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.84 -179.523 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.576 ' HB3' HD11 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -60.15 -12.1 7.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.108 178.378 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.746 HD21 ' HG ' ' A' ' 9' ' ' LEU . 55.5 mt -89.29 -65.7 0.99 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.529 179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.466 ' HA ' HD23 ' A' ' 57' ' ' LEU . 4.2 mm-40 -63.09 -16.36 59.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.17 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 94' ' ' HIS . 56.6 tt0 -87.83 -10.73 49.95 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.745 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 1.041 HD13 HD23 ' A' ' 5' ' ' LEU . 30.0 tp -81.4 -57.18 3.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.644 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 41.1 t -62.35 -31.13 50.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.276 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -69.4 -40.61 77.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.919 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.293 -0.861 . . . . 0.0 110.921 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.8 mmt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.785 0.326 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -73.65 123.17 23.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.977 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -179.83 -34.65 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.488 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 tptm -59.96 -17.44 38.09 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 116.611 0.205 . . . . 0.0 110.928 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.744 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -49.27 -25.56 2.43 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.111 -0.699 . . . . 0.0 109.111 178.041 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -59.29 -41.2 88.39 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.832 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -50.42 -31.45 15.04 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.204 0.526 . . . . 0.0 110.001 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.669 ' O ' HD13 ' A' ' 8' ' ' LEU . 2.8 tm? -83.49 -30.61 27.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.024 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.668 ' HB3' HD11 ' A' ' 41' ' ' ILE . 8.8 mt -60.79 -42.78 98.25 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.555 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -45.5 -40.05 8.05 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.487 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.421 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 5.4 m-20 -54.65 -43.02 72.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.987 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.972 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -56.57 -63.36 1.22 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.534 179.805 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.775 ' HA ' HD23 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -52.41 -37.77 57.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.314 -179.14 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -75.18 -26.73 59.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.941 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.892 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -68.89 -28.52 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.09 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 1.015 HD12 HD13 ' A' ' 19' ' ' LEU . 1.6 mm? -67.48 -34.63 77.55 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.312 179.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 ttpp -40.45 -33.94 0.3 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.151 0.501 . . . . 0.0 110.515 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.888 ' HB3' HG23 ' A' ' 81' ' ' THR . 2.2 m-20 -81.18 -41.53 22.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.905 178.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 1.015 HD13 HD12 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -51.72 -29.93 20.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.128 179.722 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.972 ' CE1' HD12 ' A' ' 30' ' ' LEU . 76.2 m-70 -62.19 -37.51 85.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.021 0.439 . . . . 0.0 110.836 -179.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.545 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 4.3 mmpt? -94.5 16.85 14.29 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.034 -178.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.497 ' HB2' HG21 ' A' ' 81' ' ' THR . 7.6 m-80 -145.41 -20.12 0.48 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -179.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.967 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -63.75 -27.66 69.35 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 119.719 -0.793 . . . . 0.0 110.959 -179.608 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.46 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 86.2 t60 -178.86 -53.13 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.889 0.376 . . . . 0.0 110.643 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 141.68 126.83 2.2 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.874 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 90.9 94.63 1.26 Allowed Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.107 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.82 -26.65 1.72 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.753 0.311 . . . . 0.0 110.591 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -53.8 -32.25 51.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.484 179.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -86.25 -42.37 13.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.329 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.972 HD12 ' CE1' ' A' ' 20' ' ' HIS . 1.5 tm? -62.05 -35.89 79.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.838 179.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.468 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 45.3 t60 -46.61 -35.35 5.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.404 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.61 -24.1 53.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.689 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.892 ' O ' HG22 ' A' ' 67' ' ' VAL . 2.7 p -91.87 -47.17 14.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.438 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.662 ' HB2' HD11 ' A' ' 30' ' ' LEU . 6.7 t70 -71.63 -23.98 61.79 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.086 179.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.468 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 11.3 t30 -54.33 -30.69 52.18 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.741 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -69.0 -32.21 71.6 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.851 178.569 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.821 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -75.39 -64.52 1.05 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.434 179.427 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.747 ' O ' HG22 ' A' ' 41' ' ' ILE . 1.5 pt20 -47.08 -28.53 1.76 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.298 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -76.33 -28.36 56.87 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.91 0.386 . . . . 0.0 110.351 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.741 HG23 ' O ' ' A' ' 36' ' ' HIS . 78.6 t -75.92 -43.3 39.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.504 179.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.747 HG22 ' O ' ' A' ' 38' ' ' GLN . 4.7 tp -46.5 -33.11 1.84 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.13 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.056 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.562 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 1.6 mt-10 -75.57 -30.59 59.72 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.081 179.093 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.597 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 43.2 m-20 -82.79 -25.41 32.76 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.835 178.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.789 HD13 ' HE2' ' A' ' 56' ' ' LYS . 17.1 mm -86.9 -53.05 10.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.119 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.098 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.562 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -64.58 -27.71 69.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.23 -179.657 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.511 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 25.9 t0 -86.63 -46.8 9.75 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 120.907 0.384 . . . . 0.0 110.501 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.597 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.5 m-30 -66.5 -23.24 66.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.567 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.407 ' HE3' HD22 ' A' ' 96' ' ' LEU . 0.0 OUTLIER -52.8 -26.01 13.11 Favored 'General case' 0 C--N 1.334 -0.109 0 CA-C-O 120.888 0.375 . . . . 0.0 110.635 179.427 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -90.9 9.45 30.36 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.367 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.58 -2.15 58.75 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.694 -0.765 . . . . 0.0 113.082 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.36 -41.28 31.84 Favored Glycine 0 C--N 1.333 0.39 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.167 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.442 ' HA3' ' CE2' ' A' ' 47' ' ' PHE . . . -163.74 24.73 0.19 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.178 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.59 -168.32 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.883 0.373 . . . . 0.0 110.764 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.651 ' H ' HG11 ' A' ' 100' ' ' VAL . . . 88.65 -62.02 3.76 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.77 -0.728 . . . . 0.0 113.041 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.434 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . -124.57 11.55 7.96 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.386 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.789 ' HE2' HD13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -88.43 -44.23 10.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 117.034 0.417 . . . . 0.0 111.249 179.858 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.72 HD22 ' NZ ' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -59.32 -14.09 10.32 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.872 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 55' ' ' GLY . 27.1 pt20 -85.9 -50.62 6.96 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.34 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -85.87 -29.81 23.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.864 0.364 . . . . 0.0 110.655 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.645 ' HG2' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -78.3 -31.78 49.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.995 179.796 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.517 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 0.1 OUTLIER -56.86 -40.47 76.21 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.489 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.97 -19.44 61.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.929 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.536 ' HB3' HG21 ' A' ' 40' ' ' VAL . 18.7 tt0 -76.46 -31.86 58.06 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.543 -179.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.577 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.1 p90 -87.04 -25.86 24.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.88 0.371 . . . . 0.0 110.456 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -82.13 -30.96 30.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.417 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -58.48 -36.7 74.14 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.416 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.892 HG22 ' O ' ' A' ' 33' ' ' VAL . 83.4 t -54.19 -42.89 58.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.422 179.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 1.096 HD21 HG13 ' A' ' 85' ' ' ILE . 0.5 OUTLIER -74.09 -14.28 60.96 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.512 179.142 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.67 -52.19 53.53 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.417 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 5.5 tp10 -57.65 -24.57 57.26 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.528 0.68 . . . . 0.0 109.709 178.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 1.019 HD23 HG22 ' A' ' 82' ' ' VAL . 0.9 OUTLIER -70.45 -65.27 0.75 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.734 -1.121 . . . . 0.0 112.818 -178.826 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -46.53 -21.7 0.21 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.418 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.407 ' N ' ' C ' ' A' ' 71' ' ' LEU . 45.7 m-20 -83.56 -23.85 31.84 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.135 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.53 ' CB ' ' O ' ' A' ' 23' ' ' TRP . 44.1 m-70 -135.94 33.2 2.91 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 119.234 -0.986 . . . . 0.0 112.993 -179.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.64 ' CD2' HG21 ' A' ' 82' ' ' VAL . 0.0 OUTLIER -51.92 92.08 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 177.587 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.484 ' N ' ' O ' ' A' ' 74' ' ' HIS . 41.9 tp60 -64.3 69.14 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.55 -178.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 52.74 25.49 22.4 Favored Glycine 0 N--CA 1.453 -0.176 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.716 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -126.7 40.01 1.87 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.426 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.439 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -48.9 -31.47 7.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.638 0.256 . . . . 0.0 111.215 -179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -58.25 -31.72 67.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.042 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.888 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -68.02 -74.56 0.12 Allowed 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 1.019 HG22 HD23 ' A' ' 71' ' ' LEU . 12.6 t -49.09 -40.93 13.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.95 179.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.48 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 7.0 m170 -49.33 -41.86 39.86 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.189 0.519 . . . . 0.0 109.776 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -76.27 -27.07 56.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.622 178.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 1.096 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.25 -36.34 10.94 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.9 -179.865 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -71.11 -45.82 62.89 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.164 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.04 -29.74 67.52 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.732 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.8 m-80 -82.96 -67.61 0.77 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.505 179.147 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.972 ' CG1' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -52.84 -47.83 51.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.511 -179.591 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.427 ' N ' HG22 ' A' ' 89' ' ' ILE . 0.1 OUTLIER -62.3 -29.26 70.31 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.28 -0.568 . . . . 0.0 109.662 179.647 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -90.78 -4.0 56.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.168 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.732 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -78.58 -44.59 25.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.628 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -52.39 -29.19 22.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.536 179.149 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.628 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 38.1 t-80 -61.57 -65.36 0.7 Allowed 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.109 -179.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.433 ' HB3' HD11 ' A' ' 5' ' ' LEU . 40.9 m170 -62.44 -9.56 8.82 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.369 178.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.503 HD11 HD21 ' A' ' 9' ' ' LEU . 30.9 mt -89.3 -63.46 1.29 Allowed 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 120.956 0.408 . . . . 0.0 110.456 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -67.56 -12.25 59.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.219 179.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 94' ' ' HIS . 11.2 mm-40 -87.92 -26.42 22.72 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 120.912 0.386 . . . . 0.0 110.377 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.744 HD13 HD23 ' A' ' 5' ' ' LEU . 11.3 tp -66.83 -56.84 8.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.92 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.651 HG11 ' H ' ' A' ' 54' ' ' GLY . 31.9 t -63.56 -39.94 87.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.423 -179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -60.9 -33.04 72.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.837 0.351 . . . . 0.0 111.006 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.838 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 ptp . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.796 0.331 . . . . 0.0 111.204 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.567 ' O ' HD21 ' A' ' 99' ' ' LEU . 48.7 m-85 -99.32 54.61 0.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.889 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -119.53 -25.74 2.56 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.84 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -63.2 -17.63 62.62 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.61 0.205 . . . . 0.0 111.105 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.803 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -51.17 -24.02 3.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.046 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.412 ' N ' ' CE ' ' A' ' 48' ' ' MET . 33.6 p-10 -59.61 -41.13 89.66 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.896 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -48.24 -32.59 7.4 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.22 0.533 . . . . 0.0 110.048 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.618 ' C ' HD13 ' A' ' 8' ' ' LEU . 2.5 tm? -87.4 -30.3 20.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.295 179.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.835 ' HG ' HD21 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -68.92 -34.94 76.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.359 179.799 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -52.96 -43.06 66.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.302 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.41 -41.31 28.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.927 0.394 . . . . 0.0 111.001 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.007 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -57.36 -61.22 2.63 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.6 179.833 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.724 ' H ' HD23 ' A' ' 12' ' ' LEU . 7.5 tm0? -51.28 -38.04 50.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.047 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -75.67 -28.47 58.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.905 179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.818 HG13 ' HB ' ' A' ' 85' ' ' ILE . 0.3 OUTLIER -68.18 -31.08 50.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.983 179.19 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.759 ' CD1' HD13 ' A' ' 19' ' ' LEU . 3.4 mm? -60.5 -37.38 80.92 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.207 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.2 ttpt -41.78 -41.91 2.48 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.033 0.444 . . . . 0.0 110.554 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.752 ' HB3' HG23 ' A' ' 81' ' ' THR . 0.8 OUTLIER -70.9 -43.77 67.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.759 178.729 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.887 HD12 HD22 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -50.42 -44.0 55.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.572 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 1.058 ' CE1' HD12 ' A' ' 30' ' ' LEU . 78.5 m-70 -49.33 -31.3 8.96 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.502 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 6.2 mmpt? -94.24 -9.86 34.79 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -177.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.634 ' HB2' HG21 ' A' ' 81' ' ' THR . 4.8 m120 -126.37 3.82 6.99 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -179.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.779 ' CB ' HD12 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -77.06 -54.05 7.03 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.752 179.833 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.524 ' HB3' ' CZ2' ' A' ' 23' ' ' TRP . 8.7 t-160 179.39 57.6 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.921 0.391 . . . . 0.0 111.027 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 118.21 -107.5 1.48 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.302 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -124.65 -146.2 6.81 Favored Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.167 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.454 ' CD ' ' CE1' ' A' ' 20' ' ' HIS . 17.3 ttpp -94.11 -11.13 31.18 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -50.41 -65.45 0.56 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -178.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -75.14 -25.39 58.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.567 0.222 . . . . 0.0 111.111 -179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.058 HD12 ' CE1' ' A' ' 20' ' ' HIS . 2.0 tm? -72.99 -29.15 62.82 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.432 ' N ' ' O ' ' A' ' 27' ' ' LYS . 28.3 t60 -47.71 -51.85 20.51 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.527 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.11 -22.48 66.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.887 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.955 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.2 t -85.82 -62.25 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.864 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.591 ' H ' HD13 ' A' ' 30' ' ' LEU . 1.3 t0 -59.42 -25.26 64.18 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -56.41 -39.42 72.99 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 177.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.736 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -65.13 -45.85 83.39 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 177.444 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.965 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -53.51 -69.69 0.11 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.619 178.623 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.855 ' O ' HG22 ' A' ' 41' ' ' ILE . 1.6 mt-30 -46.48 -43.55 16.79 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.038 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -54.99 -26.22 35.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.05 0.452 . . . . 0.0 110.243 179.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.736 HG23 ' O ' ' A' ' 36' ' ' HIS . 32.5 t -74.36 -57.52 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.374 179.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.855 HG22 ' O ' ' A' ' 38' ' ' GLN . 0.5 OUTLIER -44.49 -35.71 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.79 -179.766 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.628 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 3.8 pt-20 -75.64 -30.29 59.41 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.829 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.517 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 2.1 m-20 -84.08 -27.56 28.17 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.885 178.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.584 HG22 ' SD ' ' A' ' 48' ' ' MET . 25.3 mm -86.99 -48.43 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.497 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.628 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -68.96 -26.83 65.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.276 -179.631 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.524 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 14.0 t70 -86.48 -41.91 14.0 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.071 0.463 . . . . 0.0 110.226 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.517 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.4 m-85 -72.14 -23.72 61.34 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.606 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.584 ' SD ' HG22 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -54.01 -34.6 60.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.981 179.752 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -73.77 -22.46 59.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.422 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 146.14 -11.8 1.61 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.428 -0.892 . . . . 0.0 113.082 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -48.36 -26.44 4.97 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.71 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 154.03 44.61 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.256 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.661 ' OG ' HG22 ' A' ' 100' ' ' VAL . 1.8 t -59.53 -29.65 68.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.731 0.3 . . . . 0.0 111.03 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -90.23 72.03 2.05 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.191 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.464 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . 149.03 -19.79 1.23 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.575 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.492 ' CD ' HD13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -88.64 -46.01 9.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.663 0.268 . . . . 0.0 111.279 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.795 HD11 ' HB3' ' A' ' 96' ' ' LEU . 5.7 tp -61.79 -10.84 9.95 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.464 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 1.6 pp0? -85.88 -50.98 6.69 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.939 179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -86.88 -30.8 21.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.997 0.427 . . . . 0.0 110.382 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.729 ' HG3' HG13 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -76.39 -29.52 57.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.616 179.637 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.508 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 2.9 tmm? -55.66 -44.69 77.47 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 121.015 0.436 . . . . 0.0 110.509 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -12.82 60.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.181 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.42 ' HB3' HG22 ' A' ' 40' ' ' VAL . 28.2 tt0 -83.2 -24.75 32.28 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.535 -179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.491 ' HB3' HG11 ' A' ' 40' ' ' VAL . 1.6 p90 -87.08 -35.38 18.74 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.902 0.382 . . . . 0.0 110.427 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.458 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 0.0 OUTLIER -79.17 -30.97 43.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.96 179.757 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -58.92 -34.93 72.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.019 0.438 . . . . 0.0 110.407 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.965 HG21 ' HB2' ' A' ' 37' ' ' LEU . 80.5 t -57.65 -44.05 84.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.418 179.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 1.033 HD11 HD13 ' A' ' 89' ' ' ILE . 0.9 OUTLIER -70.44 -9.21 55.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.611 178.799 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -71.45 -57.99 3.92 Favored 'General case' 0 C--O 1.231 0.098 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.589 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 3.5 tp10 -53.38 -37.48 62.47 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.949 0.88 . . . . 0.0 108.996 177.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.887 HD22 HD12 ' A' ' 19' ' ' LEU . 0.3 OUTLIER -70.86 -68.34 0.44 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.72 -1.582 . . . . 0.0 112.04 -179.32 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.411 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 22.5 t30 -49.3 -25.59 2.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.924 -179.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -85.28 4.17 36.15 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.656 ' O ' ' N ' ' A' ' 76' ' ' GLN . 72.2 m-70 -150.9 32.03 0.62 Allowed 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.597 ' HG ' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -50.27 82.76 0.0 OUTLIER 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.912 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.656 ' N ' ' O ' ' A' ' 74' ' ' HIS . 4.5 tt0 -84.18 -34.32 24.0 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.675 -177.512 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -88.1 -20.34 49.91 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.7 -0.762 . . . . 0.0 113.009 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.512 ' C ' HD12 ' A' ' 75' ' ' LEU . . . 130.82 130.24 3.16 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.256 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.597 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -52.76 -19.44 2.45 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -179.824 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -48.6 -39.24 23.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.696 0.284 . . . . 0.0 111.32 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.752 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -69.55 -74.15 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 178.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.872 HG13 HD21 ' A' ' 71' ' ' LEU . 25.8 t -47.77 -36.8 5.5 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.414 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.084 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.474 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 57.0 t-80 -52.45 -41.08 62.97 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -76.17 -28.26 57.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.459 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.987 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.61 -33.15 7.45 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.196 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.054 -179.728 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.575 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -75.95 -44.69 38.74 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.059 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -60.85 -29.97 69.84 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.716 ' O ' HD13 ' A' ' 92' ' ' ILE . 2.0 m-80 -82.89 -63.19 1.41 Allowed 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.065 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 1.033 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -54.5 -48.51 69.79 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.186 179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.45 ' N ' HG22 ' A' ' 89' ' ' ILE . 0.1 OUTLIER -60.88 -29.55 69.62 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.6 179.658 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -90.8 -3.44 57.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.371 178.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.716 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.1 mp -78.65 -39.05 22.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.62 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -60.45 -25.07 65.72 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.25 178.689 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.62 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 8.9 t-80 -60.56 -65.91 0.61 Allowed 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.222 -179.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.601 ' HB3' HD11 ' A' ' 5' ' ' LEU . 63.7 m80 -63.67 -9.32 13.36 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.48 178.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.835 HD21 ' HG ' ' A' ' 9' ' ' LEU . 55.2 mt -89.48 -59.7 2.14 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.127 0.489 . . . . 0.0 110.543 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.422 ' HA ' ' CD2' ' A' ' 57' ' ' LEU . 5.4 mt-10 -66.61 -11.96 55.83 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.382 179.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.533 ' HB2' ' O ' ' A' ' 94' ' ' HIS . 8.8 tt0 -94.68 3.71 54.73 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.723 0.297 . . . . 0.0 111.111 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.803 HD13 HD23 ' A' ' 5' ' ' LEU . 8.1 tp -101.66 -47.48 4.62 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.966 0.412 . . . . 0.0 110.669 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.661 HG22 ' OG ' ' A' ' 53' ' ' SER . 41.2 t -76.89 -34.12 22.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.124 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -98.33 31.33 2.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.943 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.6 tpt85 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.958 179.98 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 tpp . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.79 0.328 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -92.38 137.8 32.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.866 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.518 ' HA2' ' HG3' ' A' ' 48' ' ' MET . . . 157.6 -23.14 0.42 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.581 -0.819 . . . . 0.0 112.99 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.45 -18.62 61.68 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 116.654 0.227 . . . . 0.0 111.056 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.891 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -53.14 -21.76 5.42 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.061 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.595 ' HA ' HD12 ' A' ' 9' ' ' LEU . 38.5 p-10 -61.39 -40.18 93.4 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.815 179.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -51.38 -28.44 12.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.086 0.469 . . . . 0.0 110.012 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.814 ' O ' HD22 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -83.86 -29.38 27.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.002 179.22 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.813 ' O ' HD23 ' A' ' 12' ' ' LEU . 10.3 mt -63.79 -30.61 71.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.049 0.452 . . . . 0.0 110.792 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -54.46 -51.28 65.52 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.549 -179.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -51.25 -49.55 60.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.885 0.374 . . . . 0.0 111.33 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.044 HD21 HD11 ' A' ' 41' ' ' ILE . 0.0 OUTLIER -56.51 -60.82 2.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.615 -179.996 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.615 ' HA ' HD23 ' A' ' 16' ' ' LEU . 2.4 tt0 -53.85 -35.28 61.31 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.037 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -77.98 -26.03 48.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.228 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.848 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -70.5 -27.56 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.401 179.314 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.676 HD12 HD22 ' A' ' 19' ' ' LEU . 3.0 mm? -61.1 -36.66 80.28 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.313 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.562 ' HA ' ' CD2' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -48.68 -40.54 28.52 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.105 0.479 . . . . 0.0 110.096 179.478 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.92 -39.17 76.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.515 178.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.909 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -55.74 -53.53 55.45 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.842 -179.662 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.59 ' CA ' ' HG ' ' A' ' 30' ' ' LEU . 2.2 p80 -53.93 -15.44 1.37 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -178.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.626 ' HA ' ' CE ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -92.85 -24.12 18.59 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.674 -179.815 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.552 ' HB2' HG21 ' A' ' 81' ' ' THR . 3.4 m-80 -130.8 28.71 4.82 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.832 0.349 . . . . 0.0 111.061 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.901 ' CB ' HD12 ' A' ' 71' ' ' LEU . 2.4 p-90 -88.99 -31.84 17.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.739 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.506 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 79.7 t60 -177.9 -52.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.652 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 168.04 120.19 0.51 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.568 -0.825 . . . . 0.0 113.105 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 61.97 128.51 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.838 179.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.439 ' HD2' ' CD2' ' A' ' 20' ' ' HIS . 7.6 tttt -64.11 -16.26 61.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.597 0.237 . . . . 0.0 110.917 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -44.94 -48.98 11.34 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.483 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -77.44 -39.45 46.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.482 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.809 ' O ' HD13 ' A' ' 30' ' ' LEU . 1.8 tm? -59.81 -28.2 67.25 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.425 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 1.4 t60 -46.39 -58.73 3.47 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.306 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.43 -21.88 60.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.746 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.863 ' CG1' HG13 ' A' ' 67' ' ' VAL . 2.2 t -83.41 -65.26 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.846 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.635 ' H ' HD13 ' A' ' 30' ' ' LEU . 1.3 t0 -61.37 -25.03 66.89 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.369 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.425 ' CB ' ' O ' ' A' ' 31' ' ' HIS . 16.2 t-20 -58.77 -41.15 85.92 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 177.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.734 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -64.72 -46.95 80.09 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 177.171 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.97 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -51.44 -68.48 0.17 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.945 178.521 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.404 ' HG3' ' N ' ' A' ' 39' ' ' ASN . 9.0 pt20 -46.66 -41.77 15.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.133 -179.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.404 ' N ' ' HG3' ' A' ' 38' ' ' GLN . 1.5 t-20 -59.25 -26.54 64.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.24 179.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.772 HG12 ' CD1' ' A' ' 44' ' ' ILE . 14.9 t -70.92 -52.89 24.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.404 179.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 1.044 HD11 HD21 ' A' ' 12' ' ' LEU . 1.8 mp -46.07 -38.64 3.13 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.535 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.612 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 1.5 pt-20 -72.91 -28.74 62.65 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 120.747 0.308 . . . . 0.0 110.802 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.555 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 6.0 m-20 -84.14 -28.31 27.53 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.772 ' CD1' HG12 ' A' ' 40' ' ' VAL . 34.3 mt -86.56 -52.48 11.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.335 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.612 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -63.27 -26.76 68.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.727 -179.943 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.513 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 13.5 t70 -86.68 -36.68 18.59 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.026 0.441 . . . . 0.0 110.01 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.555 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.2 m-85 -74.22 -42.1 60.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.28 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.518 ' HG3' ' HA2' ' A' ' 3' ' ' GLY . 12.1 ptp -51.73 -24.09 5.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.331 -179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -88.71 9.29 24.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.516 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 111.27 20.36 7.1 Favored Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.991 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.407 ' CA ' ' HA ' ' A' ' 47' ' ' PHE . . . -96.45 26.95 19.3 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.706 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 98.87 29.82 7.08 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.608 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.641 ' O ' HG11 ' A' ' 100' ' ' VAL . 0.2 OUTLIER -66.31 -12.92 59.37 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.514 0.19 . . . . 0.0 111.514 -179.9 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.455 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -83.16 71.63 2.98 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.668 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.414 ' O ' ' HG2' ' A' ' 58' ' ' GLN . . . 131.1 -9.45 5.68 Favored Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.803 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.497 ' HE3' ' CG ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -88.51 -34.38 17.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.668 0.27 . . . . 0.0 111.295 -179.749 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.594 HD21 HG23 ' A' ' 44' ' ' ILE . 0.1 OUTLIER -65.51 -11.58 44.77 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -179.197 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.414 ' HG2' ' O ' ' A' ' 55' ' ' GLY . 15.1 pt20 -86.47 -50.03 7.17 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.547 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 71.4 mt-10 -85.54 -31.02 22.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.835 0.35 . . . . 0.0 110.783 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.661 ' HG3' HG13 ' A' ' 40' ' ' VAL . 0.8 OUTLIER -78.11 -33.09 50.75 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.902 179.768 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.511 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 4.5 tmm? -55.37 -39.17 69.77 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.562 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.84 -17.27 62.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.967 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.95 -31.36 45.05 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.559 ' HA ' HD22 ' A' ' 37' ' ' LEU . 0.8 OUTLIER -87.27 -24.49 24.34 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.192 0.52 . . . . 0.0 109.597 179.351 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -83.02 -33.39 26.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.164 178.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -55.48 -38.44 69.12 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.904 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.97 HG21 ' HB2' ' A' ' 37' ' ' LEU . 3.9 t -51.57 -44.39 33.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.109 0.48 . . . . 0.0 110.285 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.884 HD21 HG13 ' A' ' 85' ' ' ILE . 0.9 OUTLIER -68.4 -6.71 26.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.003 179.302 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -75.85 -59.89 2.56 Favored 'General case' 0 C--N 1.338 0.092 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.468 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -48.44 -40.7 27.04 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 122.391 1.091 . . . . 0.0 108.564 177.447 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.909 HD13 ' CG ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -70.74 -68.12 0.45 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 112.904 -1.953 . . . . 0.0 112.029 -179.421 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -51.15 -26.08 6.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.346 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -87.91 9.21 22.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.265 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.491 ' O ' ' N ' ' A' ' 76' ' ' GLN . 14.2 m-70 -158.68 35.63 0.22 Allowed 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.633 HD11 HG23 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -54.67 88.44 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.198 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 74' ' ' HIS . 3.6 tp60 -63.76 69.25 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.384 -178.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 57.11 30.68 61.0 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.401 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.428 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -130.62 39.12 1.84 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.587 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.462 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -49.47 -32.03 11.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.697 0.284 . . . . 0.0 111.26 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -63.18 -31.53 72.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.135 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.552 HG21 ' HB2' ' A' ' 22' ' ' ASN . 1.9 m -67.49 -72.57 0.16 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.908 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.808 ' CG1' HD21 ' A' ' 71' ' ' LEU . 42.9 t -51.48 -39.1 21.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.852 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.48 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.3 OUTLIER -46.6 -41.23 14.21 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 179.226 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -76.27 -29.73 57.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.729 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.884 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.38 -30.44 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.106 -179.675 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.3 OUTLIER -79.76 -46.51 16.86 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 178.929 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.428 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 1.7 mp0 -59.59 -27.51 66.34 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 177.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.529 ' O ' HD12 ' A' ' 92' ' ' ILE . 1.6 m-80 -82.71 -69.17 0.65 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.811 178.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.949 ' CG1' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -49.84 -39.39 15.01 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.445 -179.964 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.504 ' O ' ' CD2' ' A' ' 93' ' ' PHE . 28.5 mmmt -63.54 -23.55 67.43 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 119.89 -0.724 . . . . 0.0 110.002 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -90.54 -8.75 49.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.177 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.835 HD13 ' HA ' ' A' ' 89' ' ' ILE . 1.2 mp -78.75 -56.31 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.977 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.504 ' CD2' ' O ' ' A' ' 90' ' ' LYS . 0.6 OUTLIER -45.72 -44.56 13.75 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.726 179.669 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.485 ' N ' ' CG ' ' A' ' 93' ' ' PHE . 9.3 t-160 -57.52 -61.43 2.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.789 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -61.54 -11.97 13.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.502 178.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 18.7 mt -89.18 -65.55 1.01 Allowed 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.972 0.415 . . . . 0.0 110.599 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -65.71 -13.31 59.03 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.114 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.478 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 4.4 tp10 -87.07 -26.94 23.44 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-O 120.938 0.399 . . . . 0.0 110.306 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.891 HD13 HD23 ' A' ' 5' ' ' LEU . 18.8 tp -66.19 -57.74 6.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.634 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.641 HG11 ' O ' ' A' ' 53' ' ' SER . 33.5 t -64.15 -37.66 80.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.21 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -60.91 -43.15 98.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.896 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.852 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mtt . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.838 0.351 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.443 ' HB3' HD21 ' A' ' 99' ' ' LEU . 5.5 m-85 -76.17 144.72 40.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.725 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.571 ' HA2' ' HG3' ' A' ' 48' ' ' MET . . . 177.1 -34.55 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.726 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.4 tptm -63.85 -17.43 63.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.481 0.181 . . . . 0.0 111.044 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.927 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -52.38 -22.9 5.12 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.198 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.459 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 26.3 p-10 -56.95 -46.38 82.16 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.02 179.266 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -49.43 -32.16 11.2 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.089 0.471 . . . . 0.0 110.209 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.608 ' C ' HD13 ' A' ' 8' ' ' LEU . 1.7 tm? -87.85 -26.65 22.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.384 179.246 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.826 HD22 HD12 ' A' ' 41' ' ' ILE . 1.0 OUTLIER -74.41 -40.94 61.68 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.748 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -49.3 -42.05 40.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.638 -179.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -50.41 -42.32 53.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.129 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.976 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -59.57 -62.53 1.81 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.678 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.731 ' H ' HD23 ' A' ' 12' ' ' LEU . 4.0 tt0 -51.17 -35.45 36.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.977 -179.339 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -77.39 -30.92 53.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.953 179.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.892 HG11 ' ND2' ' A' ' 88' ' ' ASN . 0.4 OUTLIER -63.68 -32.48 57.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.831 179.033 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.811 ' CD1' HD13 ' A' ' 19' ' ' LEU . 3.6 mm? -59.45 -36.52 76.1 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.396 179.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.9 ttpt -43.02 -42.55 3.89 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.038 0.447 . . . . 0.0 110.291 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.68 ' HB3' HG23 ' A' ' 81' ' ' THR . 0.3 OUTLIER -70.35 -44.96 67.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.7 178.673 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.916 HD12 HD22 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -48.03 -41.49 25.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.421 -179.969 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 1.048 ' CE1' HD12 ' A' ' 30' ' ' LEU . 50.0 m-70 -51.69 -35.01 41.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.927 -179.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.53 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.0 mmpt? -92.34 1.81 57.01 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -177.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.5 ' O ' HD13 ' A' ' 75' ' ' LEU . 2.1 m-80 -142.1 10.64 1.95 Allowed 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.385 -0.526 . . . . 0.0 112.323 -179.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.794 ' CA ' HD12 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -81.53 -36.88 28.64 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.809 179.734 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.503 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 86.3 t60 -179.99 -52.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.877 0.37 . . . . 0.0 110.672 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 154.71 149.72 5.34 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.536 -0.84 . . . . 0.0 113.046 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.13 103.66 0.01 OUTLIER Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.555 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -54.14 -23.01 12.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.756 0.313 . . . . 0.0 110.696 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.73 -32.97 21.15 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.858 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -85.27 -47.57 9.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.453 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.048 HD12 ' CE1' ' A' ' 20' ' ' HIS . 2.2 tm? -59.53 -29.69 68.07 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.418 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.4 OUTLIER -45.75 -56.45 5.29 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.685 179.738 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.92 -20.24 63.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.932 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.956 ' CG1' HG13 ' A' ' 67' ' ' VAL . 1.3 t -87.34 -62.75 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.762 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.602 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -60.99 -24.91 66.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.93 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 1.5 t30 -58.64 -39.87 81.76 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 177.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.955 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.2 OUTLIER -61.68 -51.47 68.29 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.588 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.004 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -53.94 -68.12 0.21 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.965 178.651 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.772 ' O ' HG22 ' A' ' 41' ' ' ILE . 14.6 tm0? -46.81 -40.08 13.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.741 -179.239 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -69.01 -22.96 64.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.965 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.955 HG23 ' O ' ' A' ' 36' ' ' HIS . 66.5 t -78.33 -38.83 23.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.485 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.826 HD12 HD22 ' A' ' 9' ' ' LEU . 1.1 tp -48.1 -34.64 4.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.412 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -75.69 -37.33 59.62 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 120.967 0.413 . . . . 0.0 109.902 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.515 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.5 OUTLIER -62.47 -30.59 71.36 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.637 178.768 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.552 HG23 HD13 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -86.85 -35.26 8.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.581 179.128 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.414 ' NE2' HG13 ' A' ' 41' ' ' ILE . 23.5 m170 -70.19 -42.12 72.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.738 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.25 -21.76 53.23 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.998 178.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.515 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.3 m-85 -88.64 -45.25 10.0 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.985 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.571 ' HG3' ' HA2' ' A' ' 3' ' ' GLY . 14.6 ptt? -49.79 -24.76 2.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.723 0.297 . . . . 0.0 111.488 -179.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 mm100 -90.61 15.29 11.23 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.534 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 102.54 26.13 7.39 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.867 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.41 ' CA ' ' HA ' ' A' ' 47' ' ' PHE . . . -104.07 31.51 8.58 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.649 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.35 23.94 7.76 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.769 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.522 ' O ' HG21 ' A' ' 100' ' ' VAL . 55.0 p -59.74 -20.2 55.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.673 0.273 . . . . 0.0 111.408 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.517 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -93.5 76.69 1.1 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.417 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.457 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . 135.53 -12.28 4.3 Favored Glycine 0 N--CA 1.453 -0.184 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.365 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.522 ' O ' ' HB3' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.4 -53.31 4.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.909 0.385 . . . . 0.0 110.593 179.589 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.552 HD13 HG23 ' A' ' 44' ' ' ILE . 0.5 OUTLIER -54.48 -11.52 0.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.224 -179.553 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -85.53 -51.89 6.2 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.162 179.845 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.98 -26.96 23.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.951 0.405 . . . . 0.0 110.251 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.532 ' CG ' HG13 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -77.67 -36.53 51.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.273 179.464 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.487 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 1.4 tmt? -50.4 -39.12 46.12 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.911 0.386 . . . . 0.0 110.705 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.89 -22.17 66.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.206 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.412 ' HB3' HG21 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -75.4 -42.4 53.85 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -179.396 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.614 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.0 OUTLIER -73.52 -24.53 60.16 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.121 0.486 . . . . 0.0 110.157 -179.989 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -82.77 -31.96 28.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.081 178.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -37.24 74.43 Favored 'General case' 0 C--O 1.231 0.079 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.674 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 1.004 HG21 ' HB2' ' A' ' 37' ' ' LEU . 84.9 t -54.29 -39.49 43.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.474 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 1.032 HD11 HD13 ' A' ' 89' ' ' ILE . 1.0 OUTLIER -75.84 -4.88 43.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.524 178.651 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -76.04 -56.81 4.31 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.572 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 7.9 tp10 -53.38 -38.04 62.99 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 122.098 0.951 . . . . 0.0 108.536 177.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.978 HD21 HG13 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -72.77 -67.17 0.58 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 113.485 -1.689 . . . . 0.0 111.939 -179.402 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.437 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 23.2 t-20 -50.68 -26.04 5.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.447 -179.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 21.9 m-20 -87.68 7.77 28.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.517 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.514 ' O ' ' N ' ' A' ' 76' ' ' GLN . 72.9 m-70 -154.09 31.92 0.44 Allowed 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.576 HD12 ' C ' ' A' ' 78' ' ' GLY . 0.2 OUTLIER -50.32 90.27 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.289 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -66.25 68.85 0.06 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.417 -177.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 58.44 24.78 56.81 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.75 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.576 ' C ' HD12 ' A' ' 75' ' ' LEU . . . -130.96 46.23 1.09 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.236 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.46 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.2 OUTLIER -55.41 -32.5 62.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.693 0.283 . . . . 0.0 111.296 -179.697 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 37.4 p-80 -57.47 -33.43 67.97 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.052 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.68 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -67.15 -74.36 0.12 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.978 HG13 HD21 ' A' ' 71' ' ' LEU . 29.1 t -50.66 -42.06 21.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.2 179.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.467 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 42.4 t60 -48.83 -41.09 31.81 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.426 ' O ' ' HB3' ' A' ' 88' ' ' ASN . 84.7 t60 -76.47 -27.58 56.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.752 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 1.03 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.48 -33.1 7.48 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.149 -179.63 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.481 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -74.38 -45.71 45.1 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 179.102 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -59.14 -29.9 67.75 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 177.943 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.892 ' ND2' HG11 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -83.08 -58.63 2.77 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.494 179.344 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 1.032 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -60.57 -48.13 89.88 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.359 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.396 -179.313 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.425 ' N ' HG22 ' A' ' 89' ' ' ILE . 0.6 OUTLIER -61.5 -29.11 69.77 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 120.124 -0.631 . . . . 0.0 109.818 179.784 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -90.68 -2.41 57.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.196 178.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.774 HD13 ' O ' ' A' ' 88' ' ' ASN . 0.9 OUTLIER -77.82 -42.58 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.229 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.64 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -55.95 -27.95 54.76 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.13 178.842 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.64 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 16.9 t60 -62.39 -64.15 1.01 Allowed 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.25 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.434 ' HB3' HD11 ' A' ' 5' ' ' LEU . 4.7 m-70 -63.35 -9.86 13.99 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.127 178.499 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.758 HD21 ' HG ' ' A' ' 9' ' ' LEU . 32.7 mt -89.25 -63.37 1.3 Allowed 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.905 0.384 . . . . 0.0 110.317 179.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -63.36 -13.95 44.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.011 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -85.16 -28.7 25.32 Favored 'General case' 0 N--CA 1.458 -0.05 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.553 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.927 HD13 HD23 ' A' ' 5' ' ' LEU . 18.8 tp -62.66 -53.93 47.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.845 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.522 HG21 ' O ' ' A' ' 53' ' ' SER . 38.9 t -71.68 -27.84 29.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.36 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -94.83 33.57 1.46 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.142 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.911 179.851 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.796 0.331 . . . . 0.0 111.224 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -77.83 118.72 20.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.769 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 174.36 -31.45 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.805 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.3 tptt -59.13 -17.32 25.73 Favored 'General case' 0 CA--C 1.514 -0.412 0 O-C-N 122.825 -0.221 . . . . 0.0 111.136 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 1.048 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -50.46 -24.73 3.31 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.057 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.567 ' HA ' HD12 ' A' ' 9' ' ' LEU . 22.4 p-10 -57.95 -41.3 82.57 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.68 178.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -50.26 -30.99 12.99 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.179 0.514 . . . . 0.0 109.88 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.611 ' C ' HD13 ' A' ' 8' ' ' LEU . 2.4 tm? -84.96 -30.46 24.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.091 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.752 ' O ' HD23 ' A' ' 12' ' ' LEU . 15.5 mt -63.56 -34.36 77.64 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.563 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -53.77 -42.18 67.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.269 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.43 -46.81 69.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.945 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.902 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -58.31 -60.48 3.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.677 179.995 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.752 ' HA ' HD23 ' A' ' 16' ' ' LEU . 0.4 OUTLIER -52.59 -36.44 56.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.082 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -77.1 -29.91 55.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.249 -0.432 . . . . 0.0 109.901 179.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.878 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -64.09 -26.86 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.855 178.871 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' A' ' 13' ' ' GLN . 2.5 mm? -63.35 -35.91 81.96 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.694 178.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -42.98 -35.06 1.11 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.244 0.545 . . . . 0.0 110.076 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.672 ' HB3' HG23 ' A' ' 81' ' ' THR . 0.8 OUTLIER -78.38 -49.92 12.68 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.064 178.818 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.809 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -47.37 -43.64 23.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.468 -179.885 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.783 ' N ' HD23 ' A' ' 19' ' ' LEU . 30.1 m170 -49.49 -36.5 23.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.913 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.446 ' HE3' ' HB2' ' A' ' 20' ' ' HIS . 4.2 mmpt? -90.21 4.66 49.92 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.624 ' HB2' HG21 ' A' ' 81' ' ' THR . 9.8 m120 -148.61 18.59 1.03 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.998 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.927 ' CG ' HD23 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -88.05 -52.7 5.11 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.39 179.316 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.555 ' HB3' ' CZ2' ' A' ' 23' ' ' TRP . 10.6 t-160 179.94 52.1 0.0 OUTLIER 'General case' 0 C--O 1.232 0.153 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.223 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 70.63 120.62 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.255 0 N-CA-C 115.205 0.842 . . . . 0.0 115.205 177.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.78 130.02 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 115.207 -0.496 . . . . 0.0 114.321 177.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.457 ' HG3' ' CD2' ' A' ' 20' ' ' HIS . 3.5 ttpt -68.05 -14.85 63.29 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.398 -0.401 . . . . 0.0 110.023 178.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -46.79 -47.64 20.85 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.47 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -75.68 -46.98 28.21 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.801 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.927 HD23 ' CG ' ' A' ' 23' ' ' TRP . 0.3 OUTLIER -58.47 -28.02 64.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.004 0.43 . . . . 0.0 109.993 179.223 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.431 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 1.2 t60 -45.66 -48.76 14.87 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.451 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.09 -31.14 71.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.246 0.546 . . . . 0.0 110.142 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.931 ' CG1' HG13 ' A' ' 67' ' ' VAL . 2.4 t -72.32 -62.43 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.742 179.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.432 ' N ' HG12 ' A' ' 33' ' ' VAL . 0.8 OUTLIER -61.53 -21.57 64.37 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.307 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.431 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 0.6 OUTLIER -60.13 -41.18 92.14 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 177.312 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.633 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.3 OUTLIER -64.69 -49.74 69.76 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 177.205 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.034 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -51.92 -67.15 0.27 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.763 178.505 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.28 -42.88 10.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.812 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.9 m-20 -58.25 -30.32 66.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.031 179.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.767 HG12 HG13 ' A' ' 44' ' ' ILE . 21.7 t -65.19 -50.31 74.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.162 179.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.856 HD11 HD21 ' A' ' 12' ' ' LEU . 12.5 mm -44.24 -41.15 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.758 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.618 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 0.5 OUTLIER -72.65 -29.89 63.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.703 0.287 . . . . 0.0 111.018 -179.743 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.537 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.3 OUTLIER -84.32 -26.39 28.53 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 178.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.767 HG13 HG12 ' A' ' 40' ' ' VAL . 6.4 mm -87.3 -50.57 13.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.353 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.618 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -67.21 -26.95 66.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.353 -179.597 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.524 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 9.9 t0 -86.48 -40.87 14.87 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 121.039 0.447 . . . . 0.0 110.054 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.537 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.4 m-85 -73.72 -25.41 60.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.442 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.738 ' SD ' HG22 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -50.62 -39.11 49.39 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.001 0.429 . . . . 0.0 110.83 179.466 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -67.04 -25.29 66.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.757 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 130.12 -3.41 5.95 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.894 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.91 -36.32 26.68 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.141 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.4 ' HA3' ' CD2' ' A' ' 47' ' ' PHE . . . -162.56 25.13 0.22 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 121.054 -0.594 . . . . 0.0 112.178 179.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.89 -175.87 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.899 0.38 . . . . 0.0 110.98 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 50.02 59.7 7.27 Favored Glycine 0 CA--C 1.517 0.217 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.66 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 147.9 -19.76 1.43 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.624 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.446 ' O ' ' CB ' ' A' ' 60' ' ' MET . 3.6 pptp? -88.18 -41.28 13.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.778 0.323 . . . . 0.0 111.023 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.672 HD11 ' HB3' ' A' ' 96' ' ' LEU . 14.1 tp -65.55 -9.72 28.86 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.884 -179.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -86.3 -49.41 7.7 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.826 179.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -87.31 -31.17 20.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.439 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.675 ' HG3' HG13 ' A' ' 40' ' ' VAL . 1.3 tpt -77.54 -30.82 52.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.845 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.52 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -56.24 -43.0 78.22 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.265 179.678 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.79 -20.18 63.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.02 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -74.29 -29.42 61.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.464 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.826 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.4 p90 -87.08 -28.97 22.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.962 0.411 . . . . 0.0 110.682 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.46 ' CG ' ' CE1' ' A' ' 64' ' ' PHE . 4.1 mt-30 -81.23 -34.14 32.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.92 179.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 9.0 tm0? -56.58 -35.13 67.85 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.855 0.36 . . . . 0.0 110.787 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 1.034 HG21 ' HB2' ' A' ' 37' ' ' LEU . 9.5 t -55.62 -49.11 76.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.327 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.986 HD11 HD13 ' A' ' 89' ' ' ILE . 1.2 mp -65.1 -10.85 33.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.738 179.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -69.54 -59.86 2.7 Favored 'General case' 0 N--CA 1.458 -0.068 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.483 ' CG ' ' CZ3' ' A' ' 23' ' ' TRP . 0.8 OUTLIER -48.91 -40.91 31.83 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 122.232 1.015 . . . . 0.0 109.198 177.769 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.918 HD21 HG13 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -69.99 -67.78 0.46 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 113.313 -1.767 . . . . 0.0 112.207 -179.279 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.503 ' ND2' HG11 ' A' ' 82' ' ' VAL . 14.2 m120 -49.24 -30.0 6.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.033 -179.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -87.4 9.4 20.79 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.628 0.232 . . . . 0.0 111.628 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.507 ' O ' ' N ' ' A' ' 76' ' ' GLN . 85.4 m-70 -151.98 27.89 0.61 Allowed 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.636 HD11 HG23 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -51.38 89.34 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 178.32 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.507 ' N ' ' O ' ' A' ' 74' ' ' HIS . 3.9 mm-40 -66.36 68.09 0.06 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.19 -178.352 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.421 ' N ' ' O ' ' A' ' 75' ' ' LEU . . . 56.36 46.56 86.72 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.66 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.437 ' HA3' ' ND2' ' A' ' 22' ' ' ASN . . . -152.21 39.39 0.76 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.502 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.48 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -46.89 -39.73 12.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.716 0.293 . . . . 0.0 111.332 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 31.7 t60 -47.99 -33.57 8.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.55 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.672 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.3 m -67.97 -73.53 0.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.262 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.918 HG13 HD21 ' A' ' 71' ' ' LEU . 25.3 t -50.15 -40.31 17.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.037 179.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.475 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 10.3 t60 -48.91 -41.14 32.61 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -76.61 -28.87 56.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.801 178.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.96 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -85.28 -31.16 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.137 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.012 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.1 OUTLIER -76.01 -48.41 21.13 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.568 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.77 -30.06 60.64 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 177.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.691 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.9 m-80 -83.08 -59.52 2.45 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.676 179.152 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.986 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -60.96 -50.32 81.05 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.882 -179.323 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.512 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 1.3 mptp? -61.43 -29.09 69.72 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.878 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -90.69 0.13 57.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.982 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.691 HD13 ' O ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER -78.67 -45.01 25.66 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.031 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.637 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -53.05 -26.35 15.59 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.081 178.419 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.637 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.7 OUTLIER -60.29 -64.22 1.03 Allowed 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.296 -179.365 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.843 ' HB3' HD11 ' A' ' 5' ' ' LEU . 21.8 m-70 -66.02 -9.52 31.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.351 178.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.672 ' HB3' HD11 ' A' ' 57' ' ' LEU . 34.9 mt -89.17 -58.16 2.64 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 120.944 0.402 . . . . 0.0 110.442 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.461 ' N ' HD21 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -70.68 -10.93 60.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.061 178.78 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -90.7 -12.99 35.01 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.969 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 1.048 HD13 HD23 ' A' ' 5' ' ' LEU . 4.5 tp -87.11 -56.58 3.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.002 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 45.9 t -62.98 -46.03 97.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.273 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -60.04 -30.03 68.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.011 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.145 -0.931 . . . . 0.0 110.857 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mtt . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 120.787 0.327 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.585 ' HB3' HD11 ' A' ' 99' ' ' LEU . 2.6 m-85 -96.52 90.59 5.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.837 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -131.73 3.82 5.38 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.734 -0.746 . . . . 0.0 113.068 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -82.31 -21.63 36.0 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 116.856 0.328 . . . . 0.0 110.971 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.79 HD23 HD13 ' A' ' 99' ' ' LEU . 0.2 OUTLIER -51.26 -21.98 2.46 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.371 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.458 ' HA ' ' HB2' ' A' ' 9' ' ' LEU . 8.5 t30 -62.46 -40.41 96.54 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.789 178.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -50.44 -30.12 11.83 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.226 0.536 . . . . 0.0 109.745 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.753 ' O ' HD13 ' A' ' 8' ' ' LEU . 2.9 tm? -85.67 -27.71 25.19 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.953 178.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.73 ' O ' HD23 ' A' ' 12' ' ' LEU . 13.4 mt -70.83 -13.06 61.9 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.092 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -75.4 -42.21 54.27 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.805 0.336 . . . . 0.0 111.322 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -56.53 -48.17 77.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.186 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.922 HD12 ' CG1' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -54.78 -58.84 5.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.632 -179.874 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.723 ' HA ' HD23 ' A' ' 16' ' ' LEU . 1.4 tt0 -52.38 -35.54 51.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.955 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.87 -28.18 49.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.973 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.87 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -67.64 -26.8 36.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.196 179.286 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.723 HD23 ' HA ' ' A' ' 13' ' ' GLN . 2.4 mm? -62.85 -36.15 82.28 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.247 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.432 ' HA ' ' CE ' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -46.66 -40.27 12.85 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.047 0.451 . . . . 0.0 109.933 179.397 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.579 ' HB3' HG23 ' A' ' 81' ' ' THR . 0.6 OUTLIER -68.21 -41.01 81.94 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.241 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.935 HD12 HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -57.22 -38.37 73.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.737 179.534 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.953 ' CE1' HD12 ' A' ' 30' ' ' LEU . 39.8 m-70 -51.68 -34.84 40.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.853 0.359 . . . . 0.0 111.144 179.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.533 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.7 mmpt? -94.15 2.36 55.97 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -178.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.675 ' HB2' HG21 ' A' ' 81' ' ' THR . 0.7 OUTLIER -139.54 5.75 2.24 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -179.548 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.987 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -80.47 -37.11 32.47 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.109 179.41 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.494 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 86.0 t60 -176.75 -49.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.736 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 146.86 132.38 2.31 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.102 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 80.48 101.25 0.31 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.522 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.84 -25.45 7.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.753 0.311 . . . . 0.0 110.451 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.81 -31.48 49.28 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.432 179.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -85.25 -42.88 14.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.343 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.987 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.2 tm? -62.76 -34.72 77.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.868 -0.606 . . . . 0.0 109.923 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.474 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 33.7 t-80 -47.74 -39.49 17.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.214 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -76.59 -21.89 54.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.676 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.823 ' O ' HG22 ' A' ' 67' ' ' VAL . 1.6 p -91.66 -46.73 14.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.716 -0.22 . . . . 0.0 111.254 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.581 ' HB2' HD11 ' A' ' 30' ' ' LEU . 2.7 t70 -72.97 -27.16 61.65 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.264 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 1.1 t30 -53.94 -32.68 54.48 Favored 'General case' 0 C--O 1.231 0.127 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 178.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.863 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -63.73 -34.36 77.69 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.287 178.384 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.676 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -71.3 -66.3 0.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.195 179.202 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -47.37 -35.69 8.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.015 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -70.16 -31.71 69.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.229 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.87 HG12 HD11 ' A' ' 44' ' ' ILE . 49.5 t -71.49 -36.9 62.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.213 179.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.669 HD11 HD21 ' A' ' 12' ' ' LEU . 35.2 mm -49.79 -35.42 10.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.851 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.572 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -75.64 -25.39 56.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.202 179.326 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.564 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 3.3 m-20 -82.19 -27.24 32.73 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.621 178.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.87 HD11 HG12 ' A' ' 40' ' ' VAL . 0.1 OUTLIER -87.08 -52.71 11.33 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.121 179.321 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.572 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -62.13 -27.31 68.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.707 0.289 . . . . 0.0 110.701 -179.733 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.51 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 11.7 t0 -86.83 -32.55 20.23 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.087 0.47 . . . . 0.0 110.161 179.446 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.564 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 3.3 m-85 -81.6 -45.87 15.21 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.703 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.425 ' HB3' ' HE2' ' A' ' 48' ' ' MET . 11.5 ptp -50.23 -24.4 2.84 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.446 -179.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -89.92 13.14 15.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.628 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 104.73 25.94 6.65 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.787 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -102.14 27.01 22.28 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.561 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 101.78 27.34 7.13 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.543 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.522 ' O ' HG11 ' A' ' 100' ' ' VAL . 0.1 OUTLIER -64.89 -15.73 62.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.659 0.266 . . . . 0.0 111.35 -179.917 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.46 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -85.82 73.26 2.59 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.61 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 131.92 -12.43 5.33 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.635 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.534 ' HZ3' ' HB3' ' A' ' 60' ' ' MET . 0.0 OUTLIER -88.39 -28.14 21.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.612 0.244 . . . . 0.0 110.956 -179.881 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.517 ' O ' ' HB2' ' A' ' 61' ' ' MET . 0.4 OUTLIER -70.16 -9.2 54.92 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 121.021 -0.272 . . . . 0.0 111.722 -179.679 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.402 ' CG ' ' N ' ' A' ' 59' ' ' GLU . 15.1 pt20 -86.77 -50.81 6.48 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.615 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.402 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 0.4 OUTLIER -86.22 -31.74 21.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.802 -179.726 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.534 ' HB3' ' HZ3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -78.39 -30.8 48.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.098 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.517 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -59.37 -41.75 90.05 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.316 179.708 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -60.78 -19.47 59.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.576 179.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.622 ' HB3' HG21 ' A' ' 40' ' ' VAL . 15.8 tt0 -74.26 -31.35 62.52 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.508 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.558 ' HA ' HD22 ' A' ' 37' ' ' LEU . 1.0 OUTLIER -87.41 -26.37 23.33 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.01 0.433 . . . . 0.0 109.891 179.608 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -82.51 -32.2 28.83 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.877 178.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -59.03 -33.62 70.95 Favored 'General case' 0 C--O 1.23 0.063 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.488 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.823 HG22 ' O ' ' A' ' 33' ' ' VAL . 87.9 t -54.96 -38.35 45.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.178 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 1.039 HD21 HG13 ' A' ' 85' ' ' ILE . 1.8 mp -74.98 -7.55 53.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.513 178.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -74.31 -59.45 2.72 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.501 ' HB3' HG21 ' A' ' 33' ' ' VAL . 6.8 tp10 -51.67 -34.48 38.48 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 122.029 0.919 . . . . 0.0 108.786 177.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.935 HD13 HD12 ' A' ' 19' ' ' LEU . 0.3 OUTLIER -72.53 -65.78 0.74 Allowed 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 113.613 -1.631 . . . . 0.0 111.806 -179.418 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.482 ' HA ' HD22 ' A' ' 75' ' ' LEU . 15.1 t-20 -51.18 -24.27 4.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.851 -179.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -85.14 2.78 42.08 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -179.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.578 ' O ' ' N ' ' A' ' 76' ' ' GLN . 2.4 m-70 -151.53 36.34 0.57 Allowed 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.677 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.663 HD11 HG23 ' A' ' 82' ' ' VAL . 0.2 OUTLIER -52.08 86.55 0.0 OUTLIER 'General case' 0 C--O 1.231 0.119 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.733 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.578 ' N ' ' O ' ' A' ' 74' ' ' HIS . 0.0 OUTLIER -79.16 -39.17 34.14 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.485 -177.399 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -101.1 25.15 29.36 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 120.505 -0.855 . . . . 0.0 114.077 -178.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 88.8 127.32 2.9 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.352 -0.928 . . . . 0.0 112.855 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.561 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -50.46 -19.97 1.01 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.606 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -40.86 -38.16 0.9 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.749 0.309 . . . . 0.0 111.615 -179.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.675 HG21 ' HB2' ' A' ' 22' ' ' ASN . 1.3 m -69.48 -73.34 0.16 Allowed 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 178.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.791 ' CG1' HD21 ' A' ' 71' ' ' LEU . 41.8 t -47.39 -37.02 4.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.975 179.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.505 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -50.52 -41.46 53.75 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.1 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -76.43 -27.9 56.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.537 178.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 1.039 HG13 HD21 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -84.07 -33.98 9.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.731 179.972 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.587 ' O ' ' HB2' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -74.31 -51.7 14.43 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 178.939 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.426 ' NE2' ' HA ' ' A' ' 87' ' ' GLN . 3.0 mm-40 -54.16 -28.19 38.61 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.245 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -83.01 -67.12 0.81 Allowed 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.08 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.969 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -50.46 -33.45 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.528 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.587 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 0.9 OUTLIER -67.75 -24.82 65.39 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.717 -0.793 . . . . 0.0 109.609 179.798 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -86.88 -4.95 59.23 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.075 178.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.834 HD13 ' HA ' ' A' ' 89' ' ' ILE . 1.7 mp -78.47 -57.86 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 179.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.489 ' CD1' ' C ' ' A' ' 93' ' ' PHE . 0.2 OUTLIER -46.12 -44.79 16.0 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.561 178.958 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.48 ' N ' ' CG ' ' A' ' 93' ' ' PHE . 1.1 t60 -57.92 -61.4 2.56 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.958 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.594 ' HB3' HD11 ' A' ' 5' ' ' LEU . 1.4 m-70 -61.44 -12.19 13.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.526 178.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.675 ' HG ' ' O ' ' A' ' 92' ' ' ILE . 20.3 mt -89.25 -65.47 1.01 Allowed 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.927 0.394 . . . . 0.0 110.494 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -64.12 -14.07 52.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.201 179.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.432 ' CB ' ' O ' ' A' ' 94' ' ' HIS . 3.5 tp10 -86.7 -24.98 25.01 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.559 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.79 HD13 HD23 ' A' ' 5' ' ' LEU . 7.5 tp -70.46 -57.14 5.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.626 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.522 HG11 ' O ' ' A' ' 53' ' ' SER . 42.3 t -60.09 -28.47 41.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.18 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -96.08 32.99 1.8 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.136 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.862 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.6 mtt . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.776 0.322 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.518 ' HB3' ' HB3' ' A' ' 99' ' ' LEU . 9.3 m-85 -103.81 66.76 0.86 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.865 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -123.2 -21.63 2.5 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.708 -0.758 . . . . 0.0 113.007 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.412 ' HA ' ' CE ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -60.44 -18.83 53.63 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 116.807 0.303 . . . . 0.0 111.38 -179.727 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.76 HD13 ' HB3' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -52.84 -20.99 3.69 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.352 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.497 ' HA ' HD12 ' A' ' 9' ' ' LEU . 24.4 p-10 -54.3 -44.71 72.21 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.362 178.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -53.83 -29.43 40.92 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.76 ' HB3' HD13 ' A' ' 5' ' ' LEU . 1.5 tm? -87.41 -28.61 22.04 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.782 178.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.83 ' O ' HD23 ' A' ' 12' ' ' LEU . 10.7 mt -60.11 -35.67 75.76 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 121.179 0.514 . . . . 0.0 109.85 179.372 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -55.37 -37.7 67.87 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.153 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.2 -53.01 39.07 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.965 0.412 . . . . 0.0 110.725 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.898 ' O ' HG12 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -54.78 -57.1 12.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.322 179.55 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.671 ' HA ' HD23 ' A' ' 16' ' ' LEU . 31.0 tt0 -52.18 -36.48 51.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.795 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.57 -30.66 57.13 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.898 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -62.81 -26.23 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.828 178.753 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.692 HD12 HD13 ' A' ' 19' ' ' LEU . 3.2 mm? -65.52 -32.77 74.55 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.539 178.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.18 -37.11 2.96 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.232 0.539 . . . . 0.0 110.146 179.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.661 ' HB3' HG23 ' A' ' 81' ' ' THR . 11.1 m120 -77.4 -49.21 15.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.986 178.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.848 ' CG ' HD13 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -43.22 -49.33 6.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.818 -179.88 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.836 ' CD2' HD12 ' A' ' 30' ' ' LEU . 41.0 m80 -48.21 -40.54 24.66 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -179.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.487 ' HE3' ' HB2' ' A' ' 20' ' ' HIS . 2.8 mmpt? -87.25 7.61 27.73 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -177.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.583 ' HB2' HG21 ' A' ' 81' ' ' THR . 70.0 m-80 -153.93 19.25 0.51 Allowed 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.315 -0.554 . . . . 0.0 112.195 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.78 ' CB ' HD12 ' A' ' 71' ' ' LEU . 0.5 OUTLIER -87.05 -33.7 19.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.986 0.422 . . . . 0.0 110.08 178.972 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.51 ' HB3' ' CE2' ' A' ' 23' ' ' TRP . 3.7 t60 -177.15 -51.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.579 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 160.26 130.26 1.11 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.464 -0.874 . . . . 0.0 113.12 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.68 120.39 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.74 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HD2' ' CG ' ' A' ' 20' ' ' HIS . 18.8 tttt -62.22 -18.64 61.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.651 0.262 . . . . 0.0 110.771 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -50.25 -41.01 49.51 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.98 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -77.86 -49.49 14.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.491 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.836 HD12 ' CD2' ' A' ' 20' ' ' HIS . 1.4 tm? -56.42 -30.23 62.55 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.3 OUTLIER -45.79 -43.96 13.63 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.995 179.993 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.64 -26.23 64.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.081 0.467 . . . . 0.0 110.54 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.887 ' CG1' HG13 ' A' ' 67' ' ' VAL . 2.3 t -83.5 -62.29 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.888 179.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.701 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -58.5 -23.05 57.03 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.333 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 0.7 OUTLIER -59.73 -41.08 90.11 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 177.77 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.797 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.8 OUTLIER -62.69 -49.48 74.94 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 177.485 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.002 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -56.15 -68.71 0.18 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.571 178.358 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -47.13 -43.86 21.07 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.27 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -61.24 -27.99 68.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.551 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 36' ' ' HIS . 68.0 t -76.0 -41.48 38.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.557 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.793 HD11 HD21 ' A' ' 12' ' ' LEU . 25.9 mm -47.91 -36.8 5.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.164 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.58 ' HA ' ' CD2' ' A' ' 45' ' ' HIS . 0.1 OUTLIER -71.8 -29.1 64.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.433 179.646 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.555 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 13.7 m-20 -84.19 -27.27 28.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.931 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.732 HG13 HG12 ' A' ' 40' ' ' VAL . 1.8 mt -86.85 -52.77 11.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.188 179.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.58 ' CD2' ' HA ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -62.7 -28.12 69.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.237 -179.782 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.52 ' N ' ' CD2' ' A' ' 45' ' ' HIS . 39.0 t0 -86.77 -38.68 16.66 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 120.961 0.41 . . . . 0.0 110.316 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.555 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.2 m-85 -77.68 -24.01 49.41 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.711 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.481 ' CE ' HD13 ' A' ' 99' ' ' LEU . 0.8 OUTLIER -52.41 -36.98 55.56 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 121.093 0.473 . . . . 0.0 110.502 179.482 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -71.67 -11.22 60.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.124 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 118.62 20.78 4.13 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.752 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -86.37 27.56 5.64 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.44 -0.886 . . . . 0.0 111.954 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.405 ' O ' ' HG2' ' A' ' 56' ' ' LYS . . . 115.7 27.39 3.05 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.121 -0.561 . . . . 0.0 112.12 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.514 ' O ' HG22 ' A' ' 100' ' ' VAL . 16.4 t -85.76 36.51 0.66 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.753 0.311 . . . . 0.0 111.611 -179.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -107.1 -32.89 3.36 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.586 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.427 ' O ' ' HG3' ' A' ' 58' ' ' GLN . . . -135.62 7.95 4.26 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.986 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.562 ' HE3' ' HA ' ' A' ' 44' ' ' ILE . 0.0 OUTLIER -88.6 -41.14 12.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.983 0.42 . . . . 0.0 111.375 179.959 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.497 ' O ' ' CB ' ' A' ' 61' ' ' MET . 49.8 tp -60.26 -11.68 7.01 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.817 -0.628 . . . . 0.0 112.289 -178.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 55' ' ' GLY . 1.7 pp0? -86.24 -50.31 7.06 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.657 -0.417 . . . . 0.0 111.202 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.97 -32.23 20.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.827 0.346 . . . . 0.0 110.454 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.529 ' CG ' HG13 ' A' ' 40' ' ' VAL . 29.9 tpp -75.73 -29.78 59.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.473 179.564 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.497 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 3.0 ttt -52.58 -40.74 62.93 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.905 0.383 . . . . 0.0 110.312 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.6 tptt -63.07 -24.21 67.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.857 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.656 ' HB3' HG21 ' A' ' 40' ' ' VAL . 13.2 tt0 -70.28 -30.88 68.02 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.385 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.8 ' HA ' HD22 ' A' ' 37' ' ' LEU . 0.8 OUTLIER -86.96 -30.04 21.59 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.085 0.469 . . . . 0.0 110.228 179.866 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -82.4 -31.62 29.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.568 179.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -59.36 -37.16 77.18 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.786 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 1.002 HG21 ' HB2' ' A' ' 37' ' ' LEU . 3.9 t -53.39 -42.75 49.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.434 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 1.016 HD21 HG13 ' A' ' 85' ' ' ILE . 0.8 OUTLIER -70.76 -7.09 42.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.858 179.306 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -73.37 -55.96 5.69 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.648 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 2.6 tp10 -53.69 -38.01 63.8 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 122.018 0.913 . . . . 0.0 108.885 177.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.995 HD21 HG13 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -75.05 -70.82 0.39 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 113.686 -1.597 . . . . 0.0 112.283 -178.928 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.41 ' HA ' ' CD2' ' A' ' 75' ' ' LEU . 8.0 p-10 -49.32 -27.38 3.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.608 -179.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.409 ' N ' ' OD1' ' A' ' 72' ' ' ASN . 2.9 t-20 -91.69 13.65 17.48 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.271 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.467 ' O ' ' N ' ' A' ' 76' ' ' GLN . 63.0 m-70 -151.96 24.31 0.66 Allowed 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.581 ' CD2' HG21 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -47.63 94.74 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.887 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.467 ' N ' ' O ' ' A' ' 74' ' ' HIS . 9.9 tp60 -59.39 -61.61 2.5 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.34 -177.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.4 31.78 0.44 Allowed Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.235 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.432 ' O ' ' HB ' ' A' ' 81' ' ' THR . . . -141.15 49.36 0.78 Allowed Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.804 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.454 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -48.63 -27.52 2.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.716 0.293 . . . . 0.0 110.882 179.623 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -67.5 -26.92 66.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.954 179.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.661 HG23 ' HB3' ' A' ' 18' ' ' ASN . 1.2 m -68.04 -75.1 0.11 Allowed 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 179.274 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.995 HG13 HD21 ' A' ' 71' ' ' LEU . 21.3 t -48.3 -42.95 11.84 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.765 179.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.495 ' HA ' ' CG ' ' A' ' 86' ' ' GLU . 1.8 t60 -47.93 -42.05 26.29 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.226 0.536 . . . . 0.0 109.797 179.235 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.3 m80 -76.44 -28.42 56.58 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.675 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 1.016 HG13 HD21 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -85.48 -29.99 6.46 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.178 -179.616 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 82' ' ' VAL . 0.0 OUTLIER -76.75 -46.82 23.78 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 178.869 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.403 ' NE2' ' HA ' ' A' ' 87' ' ' GLN . 4.5 mm-40 -60.67 -27.91 68.2 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.18 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.719 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.7 m-80 -83.05 -58.31 2.91 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.263 178.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.988 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -62.17 -47.99 90.55 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.287 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.32 -179.739 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.45 ' HB2' ' O ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -61.69 -28.37 69.35 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.042 -0.663 . . . . 0.0 109.724 179.735 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -90.56 -1.26 57.88 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.09 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.719 HD13 ' O ' ' A' ' 88' ' ' ASN . 0.9 OUTLIER -78.64 -44.09 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.287 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.638 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.1 OUTLIER -55.06 -27.0 41.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.137 178.585 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.638 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 2.6 t-160 -62.75 -59.8 4.38 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.853 -179.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.45 ' O ' ' HG2' ' A' ' 98' ' ' GLU . 38.9 m170 -67.3 -11.03 56.53 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.189 178.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.583 ' HA ' HD12 ' A' ' 99' ' ' LEU . 36.6 mt -90.0 -56.97 3.02 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.004 0.431 . . . . 0.0 110.818 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -65.23 -10.63 33.46 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.472 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 95' ' ' HIS . 14.2 pt-20 -81.97 -28.07 32.87 Favored 'General case' 0 N--CA 1.461 0.091 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.508 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.716 HD21 HD23 ' A' ' 5' ' ' LEU . 1.7 mt -69.43 -64.05 0.95 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.183 0.516 . . . . 0.0 110.639 179.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 53' ' ' SER . 21.7 t -59.77 -26.58 35.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.012 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -85.39 -35.15 21.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.775 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.406 ' O ' ' CZ ' ' A' ' 2' ' ' TYR . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.141 -0.933 . . . . 0.0 110.873 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.899 0.38 . . . . 0.0 111.185 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' TYR . . . . . 0.402 ' N ' ' CD1' ' A' ' 2' ' ' TYR . 2.3 m-85 -101.09 76.88 1.77 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.841 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -130.11 3.59 5.96 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.892 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.8 tpmt? -84.12 -17.73 39.14 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 116.765 0.282 . . . . 0.0 110.649 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.93 HD23 HD13 ' A' ' 99' ' ' LEU . 0.1 OUTLIER -53.79 -20.63 5.96 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 177.985 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.435 ' HB2' ' CE1' ' A' ' 45' ' ' HIS . 35.5 p-10 -61.2 -42.6 98.87 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.677 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -49.43 -29.47 6.54 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.17 0.509 . . . . 0.0 109.802 179.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.537 ' O ' HD13 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -84.39 -34.46 23.57 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.067 179.038 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.715 ' O ' HD23 ' A' ' 12' ' ' LEU . 7.8 mt -64.07 -29.56 70.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.082 0.468 . . . . 0.0 110.598 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.63 -49.94 64.14 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.337 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -54.52 -46.07 73.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.881 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.991 ' O ' HG12 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -54.53 -61.0 2.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.491 179.747 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.809 ' HA ' HD23 ' A' ' 16' ' ' LEU . 4.9 tt0 -52.76 -37.42 59.42 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.617 -179.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.41 -30.26 53.47 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.035 0.445 . . . . 0.0 110.052 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.991 HG12 ' O ' ' A' ' 12' ' ' LEU . 0.9 OUTLIER -64.96 -27.48 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.104 178.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.969 HD13 HD11 ' A' ' 85' ' ' ILE . 2.6 mm? -61.63 -39.69 92.19 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 178.291 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.3 ttpt -39.14 -39.55 0.6 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.005 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.812 ' HB3' HG23 ' A' ' 81' ' ' THR . 7.4 m-20 -66.01 -55.68 15.47 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.419 -0.809 . . . . 0.0 108.982 178.018 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.905 HD21 HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -39.47 -47.57 1.86 Allowed 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 114.561 -1.2 . . . . 0.0 111.969 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.998 ' CE1' HD12 ' A' ' 30' ' ' LEU . 42.6 m-70 -50.64 -37.03 38.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.58 ' HE3' ' CB ' ' A' ' 20' ' ' HIS . 5.6 mmpt? -94.23 8.37 42.0 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -177.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.589 ' HB2' HG21 ' A' ' 81' ' ' THR . 35.0 m120 -152.69 10.14 0.48 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.143 -0.623 . . . . 0.0 112.57 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 1.041 ' CD1' HD23 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -75.16 -34.71 61.62 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.846 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.51 ' HB2' ' CE3' ' A' ' 23' ' ' TRP . 81.7 t60 -178.41 -50.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.672 178.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -130.88 -91.68 0.57 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.027 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -136.11 -142.52 4.51 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.888 -0.672 . . . . 0.0 111.785 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.426 ' HA ' ' HB3' ' A' ' 30' ' ' LEU . 9.8 tttm -93.62 -18.53 22.08 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.612 0.244 . . . . 0.0 111.125 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -54.66 -56.31 20.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.804 0.335 . . . . 0.0 110.928 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -79.96 -17.41 53.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.021 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.041 HD23 ' CD1' ' A' ' 23' ' ' TRP . 1.2 tm? -80.9 -31.74 35.06 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.038 0.447 . . . . 0.0 109.936 179.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.426 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 0.4 OUTLIER -51.47 -36.91 46.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.116 179.941 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -76.57 -25.22 53.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.505 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.778 ' CG1' HD22 ' A' ' 30' ' ' LEU . 1.5 p -90.35 -42.71 14.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.062 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.498 ' CB ' ' CD1' ' A' ' 30' ' ' LEU . 1.2 t0 -73.13 -31.77 64.5 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 179.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 31' ' ' HIS . 13.1 t-20 -51.97 -29.55 21.08 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.798 ' O ' HG23 ' A' ' 40' ' ' VAL . 0.9 OUTLIER -72.69 -36.41 67.87 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.344 -0.844 . . . . 0.0 109.408 178.574 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.771 ' HB2' HG21 ' A' ' 67' ' ' VAL . 0.1 OUTLIER -68.45 -66.81 0.52 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.38 179.267 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -45.39 -36.0 3.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.307 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -65.99 -31.07 71.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.943 0.402 . . . . 0.0 110.39 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.847 HG12 ' CG1' ' A' ' 44' ' ' ILE . 32.6 t -64.55 -53.86 37.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.8 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.816 HD11 HD21 ' A' ' 12' ' ' LEU . 38.3 mm -38.1 -42.35 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.935 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -71.7 -39.68 70.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.793 0.33 . . . . 0.0 110.405 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.473 ' O ' ' HB2' ' A' ' 47' ' ' PHE . 0.7 OUTLIER -71.72 -28.64 63.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.549 179.399 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.847 ' CG1' HG12 ' A' ' 40' ' ' VAL . 7.1 mm -86.83 -40.53 14.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.867 0.365 . . . . 0.0 110.686 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.687 ' NE2' HG23 ' A' ' 41' ' ' ILE . 13.7 m170 -73.87 -39.01 64.26 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.345 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -74.38 -26.09 59.89 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.473 ' HB2' ' O ' ' A' ' 43' ' ' ASP . 2.6 m-85 -88.61 -46.19 9.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.979 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.44 ' HE1' ' N ' ' A' ' 5' ' ' LEU . 8.4 ptm -46.49 -32.38 3.29 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.84 0.352 . . . . 0.0 111.406 -179.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -26.57 66.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.244 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 146.52 -13.75 1.59 Allowed Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.599 -0.81 . . . . 0.0 113.009 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -49.73 -42.65 37.13 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.86 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 168.69 39.2 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.607 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.432 ' HB3' ' HA ' ' A' ' 48' ' ' MET . 7.8 p -59.35 -24.38 63.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.735 0.302 . . . . 0.0 111.032 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.7 ' HA2' HG11 ' A' ' 100' ' ' VAL . . . -88.95 57.93 4.02 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.298 179.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 171.14 -28.1 0.11 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.937 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.609 ' HE3' HD13 ' A' ' 44' ' ' ILE . 0.6 OUTLIER -87.94 -30.04 20.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.921 0.361 . . . . 0.0 110.974 -179.866 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.601 HD13 ' HZ1' ' A' ' 56' ' ' LYS . 12.8 tp -61.53 -10.92 8.97 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.046 -0.261 . . . . 0.0 111.602 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.421 ' CG ' ' N ' ' A' ' 59' ' ' GLU . 13.4 pt20 -85.75 -49.86 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.751 -0.38 . . . . 0.0 110.798 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.421 ' N ' ' CG ' ' A' ' 58' ' ' GLN . 19.7 mm-40 -87.42 -33.8 18.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.133 0.492 . . . . 0.0 110.295 179.342 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.728 ' HG3' HG13 ' A' ' 40' ' ' VAL . 3.5 tpt -74.6 -27.19 60.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.834 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.503 ' CB ' ' O ' ' A' ' 57' ' ' LEU . 3.9 ttp -58.48 -47.61 83.49 Favored 'General case' 0 C--O 1.231 0.086 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.013 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -62.28 -24.51 67.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.512 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.426 ' HG2' HG22 ' A' ' 40' ' ' VAL . 1.1 tp10 -67.8 -32.29 72.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.318 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.555 ' HA ' HD22 ' A' ' 37' ' ' LEU . 0.9 OUTLIER -86.99 -33.47 19.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.888 0.375 . . . . 0.0 110.511 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.404 ' N ' ' CD1' ' A' ' 64' ' ' PHE . 10.2 tt0 -80.76 -32.8 35.41 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.997 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.66 -33.09 71.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.768 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.771 HG22 ' O ' ' A' ' 33' ' ' VAL . 95.1 t -58.46 -44.32 88.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.57 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 1.062 HD11 HD13 ' A' ' 89' ' ' ILE . 1.3 mp -73.21 -6.37 45.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.78 179.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -73.1 -54.37 8.68 Favored 'General case' 0 N--CA 1.457 -0.122 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.508 ' HG3' ' CZ3' ' A' ' 23' ' ' TRP . 5.3 tp10 -57.95 -31.72 67.12 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.881 0.848 . . . . 0.0 108.967 177.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 1.01 ' CD2' HG13 ' A' ' 82' ' ' VAL . 0.4 OUTLIER -76.98 -72.04 0.37 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.905 -1.498 . . . . 0.0 112.378 -178.8 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.53 ' HA ' HG11 ' A' ' 82' ' ' VAL . 0.1 OUTLIER -51.45 -26.13 7.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.46 -179.171 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -86.45 8.15 22.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.166 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.527 ' O ' ' N ' ' A' ' 76' ' ' GLN . 36.5 m-70 -146.41 29.46 1.05 Allowed 'General case' 0 CA--C 1.523 -0.094 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.586 HD11 HG23 ' A' ' 82' ' ' VAL . 0.3 OUTLIER -49.93 88.9 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.236 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 74' ' ' HIS . 1.4 tm0? -62.37 -48.75 78.38 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.94 0.4 . . . . 0.0 110.76 -178.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -172.54 34.91 0.13 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.334 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.442 ' HA3' ' ND2' ' A' ' 22' ' ' ASN . . . -142.55 49.77 0.73 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.659 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.442 ' N ' ' HD2' ' A' ' 79' ' ' LYS . 0.0 OUTLIER -45.5 -36.26 4.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.618 0.246 . . . . 0.0 111.246 179.952 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 36.0 m80 -59.72 -40.78 89.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.605 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.9 ' O ' HG22 ' A' ' 85' ' ' ILE . 1.4 m -59.28 -64.47 0.93 Allowed 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.939 179.118 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 1.01 HG13 ' CD2' ' A' ' 71' ' ' LEU . 9.5 t -60.05 -49.29 84.6 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.093 -179.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.521 ' O ' ' HB2' ' A' ' 87' ' ' GLN . 1.4 m-70 -50.77 -40.23 54.48 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.946 -0.301 . . . . 0.0 110.773 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 -75.41 -56.4 4.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.909 0.385 . . . . 0.0 110.28 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.969 HD11 HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -58.33 -32.98 46.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.751 179.477 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.619 ' HA ' HD22 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -81.16 -39.87 24.85 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.638 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.521 ' HB2' ' O ' ' A' ' 83' ' ' HIS . 1.1 mp0 -66.79 -25.94 66.71 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 177.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.791 ' O ' HD13 ' A' ' 92' ' ' ILE . 1.4 m-80 -82.65 -52.96 6.31 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.746 178.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 1.062 HD13 HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -66.18 -50.49 68.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.932 179.843 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.502 ' N ' HG22 ' A' ' 89' ' ' ILE . 0.3 OUTLIER -56.96 -27.31 61.07 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 120.43 -0.508 . . . . 0.0 109.991 -179.855 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -90.7 -5.34 55.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.354 178.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.791 HD13 ' O ' ' A' ' 88' ' ' ASN . 1.0 OUTLIER -78.6 -46.2 24.97 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 179.38 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.622 ' CD1' ' N ' ' A' ' 94' ' ' HIS . 0.2 OUTLIER -48.53 -28.92 3.69 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.348 178.976 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.622 ' N ' ' CD1' ' A' ' 93' ' ' PHE . 0.5 OUTLIER -60.12 -62.99 1.46 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.102 -179.518 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.494 ' HB3' HD11 ' A' ' 5' ' ' LEU . 1.7 m-70 -68.07 -8.72 40.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.345 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.482 ' HB2' ' HA ' ' A' ' 93' ' ' PHE . 23.0 mt -88.52 -56.17 3.42 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.995 0.426 . . . . 0.0 110.009 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.412 ' HG2' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -71.63 -9.81 58.81 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.824 178.486 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -88.16 -30.5 19.74 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.514 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.93 HD13 HD23 ' A' ' 5' ' ' LEU . 10.8 tp -67.6 -56.07 10.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.918 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.7 HG11 ' HA2' ' A' ' 54' ' ' GLY . 21.2 t -62.2 -37.99 79.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.417 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -63.73 -39.22 93.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.938 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.874 179.94 . . . . . . . . 0 0 . 1 stop_ save_