data_2ld3_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 2ld3 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.712 0.291 . . . . 0.0 111.001 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.3 mt -55.18 -32.81 62.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.004 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.3 p -53.33 -46.0 57.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.309 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.66 -46.31 89.43 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.027 0.441 . . . . 0.0 110.537 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.411 ' CG1' ' CE ' ' A' ' 63' ' ' MET . 20.6 t -56.92 -43.82 81.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.665 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -63.71 -37.53 94.86 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.644 -0.789 . . . . 0.0 111.891 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.06 -47.94 79.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.895 0.379 . . . . 0.0 110.224 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.418 HD12 ' CE2' ' A' ' 80' ' ' TYR . 0.8 OUTLIER -61.22 -41.02 96.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.072 179.387 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.06 -38.58 62.6 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 mptt -65.85 -40.54 91.8 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.496 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.4 mmt85 -63.06 -33.3 75.15 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.775 178.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.426 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.4 OUTLIER -62.58 -49.25 75.98 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.218 179.281 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.91 -37.58 74.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.162 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 tptm -59.02 -43.5 91.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.288 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.426 ' CD2' ' HA ' ' A' ' 31' ' ' LEU . 14.1 m-85 -62.47 -40.53 96.96 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.324 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.06 -45.41 79.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.668 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -59.67 -55.27 36.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.575 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 24.1 t -56.08 -38.0 51.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.933 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 49.2 t -75.25 -33.19 27.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.87 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.03 -32.52 73.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.43 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -83.08 -1.79 53.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.537 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.2 mt -89.54 -56.18 3.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.793 0.33 . . . . 0.0 111.006 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.04 3.66 4.45 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.652 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -116.69 138.34 51.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.771 0.32 . . . . 0.0 110.761 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 58.18 52.05 54.83 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.275 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.506 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 5.8 mmtm -72.05 -43.19 10.32 Favored Pre-proline 0 C--N 1.329 -0.289 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.506 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.5 Cg_exo -53.42 -48.92 19.33 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.226 1.95 . . . . 0.0 112.771 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -65.46 -38.68 90.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.531 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.613 ' O ' HG13 ' A' ' 52' ' ' ILE . 25.8 t -72.4 -56.95 8.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.621 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.575 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 28.5 p30 -58.95 -26.17 64.18 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.067 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 54.7 ttm-85 -73.69 -46.37 46.69 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.97 0.414 . . . . 0.0 111.504 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -74.96 -47.44 29.43 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.525 0.679 . . . . 0.0 109.203 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.613 HG13 ' O ' ' A' ' 48' ' ' VAL . 3.7 mt -57.91 -30.92 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.759 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.25 178.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.575 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -70.23 -55.16 9.97 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.594 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.4 ' HA ' HD11 ' A' ' 57' ' ' ILE . 28.2 p30 -59.73 -25.7 65.03 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 120.871 -0.331 . . . . 0.0 111.181 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 45.5 mt -77.44 -46.51 22.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.746 0.308 . . . . 0.0 110.226 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.69 -37.72 71.27 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.4 HD11 ' HA ' ' A' ' 54' ' ' ASN . 9.7 mt -71.4 -39.93 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.109 178.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.1 t -57.76 -55.12 38.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.506 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.414 ' CD1' ' CD1' ' A' ' 31' ' ' LEU . 2.7 mp -58.87 -47.8 88.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.424 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -60.31 -33.95 73.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.352 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.58 -49.5 77.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.327 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.66 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.5 mp -55.5 -52.9 62.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.467 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.411 ' CE ' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.25 -54.07 7.51 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.111 179.769 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.45 -24.83 67.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.598 179.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.405 ' O ' ' OG1' ' A' ' 69' ' ' THR . 1.4 mtpt -81.9 -29.11 32.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.336 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.66 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.9 mm -71.98 -37.63 61.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.031 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.86 -27.96 16.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.571 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.434 ' O ' ' CG2' ' A' ' 69' ' ' THR . 1.6 t -104.12 24.54 11.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.704 0.288 . . . . 0.0 111.58 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.434 ' CG2' ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 175.89 150.05 0.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.823 179.512 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.7 mtt -83.94 72.91 10.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.916 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 8.3 mmm -74.62 138.81 43.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.688 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.2 m -78.06 139.37 39.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.855 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -55.48 -35.02 65.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.665 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -58.27 -44.47 88.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.351 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -61.67 -32.86 73.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.285 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.463 HD13 HG22 ' A' ' 76' ' ' ILE . 22.8 mm -73.1 -36.65 51.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.742 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 37.5 tp60 -60.22 -52.28 65.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.667 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.53 -46.3 86.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.432 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -56.7 -34.21 67.21 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.418 ' CE2' HD12 ' A' ' 27' ' ' LEU . 36.5 t80 -64.5 -36.28 83.67 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.44 -37.07 77.22 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.89 178.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.58 -36.07 75.52 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.257 0.551 . . . . 0.0 109.642 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 20.9 mt -76.1 -31.66 58.8 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.066 178.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 51.1 t -69.41 -34.43 62.26 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.518 179.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 18.2 mmtt -71.98 -49.18 39.47 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.357 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.68 -42.28 82.37 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.463 179.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.401 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 72.6 m -65.08 -47.2 78.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.475 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -54.3 -44.67 72.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.623 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.64 -35.03 79.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.61 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.3 tt -60.24 -45.91 91.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.849 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.418 HD23 ' CE1' ' A' ' 34' ' ' PHE . 7.1 mt -61.58 -51.95 66.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.069 0.462 . . . . 0.0 109.809 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.1 m -56.11 -41.28 75.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.353 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.21 -40.51 90.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.547 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.4 mp -63.85 -44.14 94.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.417 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -55.85 -50.63 70.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.679 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 16.3 pttp -62.39 -28.65 69.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.101 0.477 . . . . 0.0 109.782 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.417 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.111 0 CA-C-O 120.647 0.26 . . . . 0.0 111.104 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.2 mp -53.89 -32.71 54.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.129 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.8 p -55.35 -49.68 71.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.268 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.3 mttt -68.92 -43.91 74.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.897 0.379 . . . . 0.0 110.48 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.0 t -57.12 -40.18 71.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.286 179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.53 -39.73 94.04 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.679 -0.772 . . . . 0.0 111.614 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -32.52 72.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.896 0.379 . . . . 0.0 110.087 179.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.426 HD13 ' CD2' ' A' ' 80' ' ' TYR . 0.3 OUTLIER -68.1 -49.9 58.25 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.772 179.137 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -52.99 -33.39 51.27 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.96 -39.3 79.56 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.416 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.427 ' HG3' ' CZ ' ' A' ' 34' ' ' PHE . 2.0 tpt180 -64.12 -31.97 73.36 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.96 -46.25 78.79 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.066 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -58.06 -37.37 74.3 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.859 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -59.75 -49.78 76.4 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.949 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.427 ' CZ ' ' HG3' ' A' ' 30' ' ' ARG . 11.3 m-85 -60.82 -37.87 83.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.38 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 27.3 m-80 -58.4 -43.54 88.61 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.411 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -51.15 71.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.147 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 36.8 t -57.46 -37.71 59.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.333 179.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 95.5 t -68.57 -41.84 83.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.639 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.8 t -58.17 -34.35 70.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.672 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -86.5 -16.15 37.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.326 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 12.4 mt -74.53 -50.67 17.21 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.167 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 0.1 OUTLIER 67.19 10.47 7.74 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.716 -179.706 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -131.4 152.92 50.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.729 0.299 . . . . 0.0 110.908 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 56.47 33.11 61.68 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.359 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.521 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 17.8 mmtt -53.54 -57.1 18.58 Favored Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 111.53 0.196 . . . . 0.0 111.53 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.521 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 14.2 Cg_endo -57.41 -41.76 68.94 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.391 2.061 . . . . 0.0 113.004 -179.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -64.96 -50.77 65.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.841 0.353 . . . . 0.0 111.509 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.527 ' O ' HG13 ' A' ' 52' ' ' ILE . 8.4 p -69.2 -49.74 58.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.703 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.438 ' OD1' ' N ' ' A' ' 50' ' ' ARG . 44.8 p30 -61.83 -25.14 67.33 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.105 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.438 ' N ' ' OD1' ' A' ' 49' ' ' ASN . 1.0 OUTLIER -73.47 -47.76 38.85 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.808 0.337 . . . . 0.0 111.097 179.875 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -74.76 -46.62 35.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.509 0.671 . . . . 0.0 109.382 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.4 mt -57.27 -32.57 41.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 CA-C-N 114.801 -1.09 . . . . 0.0 110.299 178.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.402 ' O ' HG13 ' A' ' 57' ' ' ILE . 9.0 tttt -69.29 -53.26 20.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.348 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.404 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 9.4 m-20 -53.78 -29.22 39.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.83 0.348 . . . . 0.0 110.861 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.1 mt -77.16 -47.92 19.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.243 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.47 ' HG3' ' N ' ' A' ' 57' ' ' ILE . 0.0 OUTLIER -56.39 -31.3 63.71 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 178.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.47 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 14.8 mt -71.6 -43.57 71.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.107 178.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -58.35 -53.14 61.69 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.772 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 23.0 mt -57.04 -52.43 56.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.791 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.4 -33.79 68.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.306 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.63 -49.35 77.82 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.107 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.658 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.9 mp -55.34 -53.22 58.96 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.446 179.127 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.4 -53.05 9.19 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.042 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.4 ' O ' ' CB ' ' A' ' 68' ' ' SER . . . -63.27 -25.09 68.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.653 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 26.4 mtpt -82.03 -28.87 32.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.132 0.491 . . . . 0.0 110.641 179.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.0 mm -71.49 -41.84 72.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.394 -179.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.66 -29.12 16.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.799 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.43 ' O ' ' CG2' ' A' ' 69' ' ' THR . 0.3 OUTLIER -101.41 21.8 13.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.527 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.43 ' CG2' ' O ' ' A' ' 68' ' ' SER . 0.5 OUTLIER 178.05 155.88 0.38 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.93 179.502 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.97 81.65 4.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.801 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.4 mmm -86.68 141.44 28.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.948 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.8 m -77.96 139.89 39.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.924 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -53.99 -31.99 52.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.95 0.405 . . . . 0.0 110.878 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -59.3 -49.09 79.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.535 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -61.87 -32.3 72.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.44 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 20.5 mm -71.75 -33.94 50.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.74 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -46.6 76.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.926 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 21.8 mmtt -63.4 -51.25 66.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.75 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -56.3 -33.71 65.82 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.426 ' CD2' HD13 ' A' ' 27' ' ' LEU . 2.9 t80 -64.44 -36.19 83.37 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.36 -36.65 77.06 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.959 178.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.91 -39.13 80.58 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 121.285 0.565 . . . . 0.0 109.644 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.1 mt -75.13 -29.49 60.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.095 178.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 64.0 t -71.04 -37.4 67.35 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.269 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -49.31 64.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.181 179.397 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.03 -35.52 80.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.145 179.287 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.425 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 7.3 t -65.69 -46.84 77.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.439 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -56.13 -47.24 78.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.117 0.484 . . . . 0.0 110.649 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.44 -31.37 72.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.735 179.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.4 ' HB3' ' O ' ' A' ' 87' ' ' SER . 4.6 tt -63.99 -42.2 97.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.954 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.4 mt -64.6 -50.34 67.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.201 0.524 . . . . 0.0 110.016 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.6 m -59.08 -39.18 81.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.838 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.4 -53.27 17.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.098 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.1 mp -58.33 -33.59 69.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.024 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.98 -51.78 50.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.851 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 10.0 pttp -57.53 -28.46 63.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.188 0.518 . . . . 0.0 110.078 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.8 mttp . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.946 -179.806 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 86.2 p . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.807 0.337 . . . . 0.0 110.843 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.9 mt -54.83 -32.89 61.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.945 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.3 p -59.11 -45.65 92.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.228 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt -57.98 -44.59 87.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.059 0.457 . . . . 0.0 110.661 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.4 ' CG1' ' HE1' ' A' ' 63' ' ' MET . 14.9 t -56.81 -44.93 82.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.612 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.73 -37.45 94.29 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.721 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.1 m -57.01 -47.27 81.24 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.993 0.425 . . . . 0.0 110.35 179.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.454 ' CD1' ' CZ ' ' A' ' 80' ' ' TYR . 5.1 tp -60.74 -41.4 95.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.166 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -54.37 -36.82 64.29 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.96 -38.71 86.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.681 178.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 mpt_? -63.18 -34.87 78.58 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.89 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.421 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 13.2 mt -63.17 -49.71 73.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.197 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.99 -36.86 73.24 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.11 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.0 tptm -59.32 -44.36 92.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.236 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.428 ' CD1' HD21 ' A' ' 91' ' ' LEU . 7.6 m-85 -62.57 -37.59 86.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.165 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -58.71 -41.6 86.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.439 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.86 -55.15 32.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.495 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.6 t -55.83 -37.87 49.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.573 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.403 ' CG2' HG12 ' A' ' 48' ' ' VAL . 61.1 t -74.22 -35.07 39.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.519 179.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -35.3 71.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.196 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.2 -31.0 68.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.838 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 pp -117.31 80.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.743 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.74 -27.64 5.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.245 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -58.64 98.9 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.877 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 95.66 40.45 4.14 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.5 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.451 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -71.58 -49.98 10.81 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.605 0.24 . . . . 0.0 111.181 -179.952 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.451 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.1 Cg_exo -53.28 -40.36 77.98 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.427 2.085 . . . . 0.0 112.657 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -59.93 -50.56 73.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.02 0.438 . . . . 0.0 110.817 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.466 ' O ' HG13 ' A' ' 52' ' ' ILE . 4.0 t -66.2 -55.32 19.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.749 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.581 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 83.9 m-20 -52.92 -27.86 20.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.049 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 48.8 ttt-85 -71.75 -53.4 13.55 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.916 0.388 . . . . 0.0 111.899 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -69.74 -43.84 71.47 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.786 0.803 . . . . 0.0 109.082 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.4 mt -59.52 -29.99 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.869 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.212 178.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.581 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -69.94 -55.11 10.51 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.403 179.717 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.4 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 27.5 p30 -60.19 -25.7 65.78 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.917 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.4 mt -79.84 -39.07 31.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.731 0.3 . . . . 0.0 110.198 179.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.73 -36.39 82.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 178.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.4 ' CD1' ' HA ' ' A' ' 54' ' ' ASN . 10.2 mt -69.93 -39.23 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.94 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.37 -45.87 83.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.128 179.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 64.0 mt -61.52 -51.1 76.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.127 179.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -58.98 -33.59 70.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.094 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.53 -49.42 76.39 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.885 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.662 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.1 mp -55.23 -51.58 66.14 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.108 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.409 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.35 -54.79 6.75 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.97 179.819 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.47 -25.18 67.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.641 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -82.13 -29.49 31.63 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 121.105 0.478 . . . . 0.0 110.483 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.662 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.8 mm -70.84 -36.53 64.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.939 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.2 mmmm -94.85 1.23 55.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.93 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.1 m -134.12 21.25 3.76 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.4 p -160.22 -167.6 1.97 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.565 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.5 mtm -125.37 33.13 5.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.492 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.1 mtp -58.04 123.69 16.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.091 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.0 m -67.58 145.57 54.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.742 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -55.15 -30.82 60.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.652 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -59.0 -45.55 90.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.314 179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -33.95 72.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.094 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 18.3 mm -72.96 -33.95 44.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.425 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.22 -46.2 91.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.564 179.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -66.37 -48.54 69.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.467 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -56.57 -33.99 66.7 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.454 ' CZ ' ' CD1' ' A' ' 27' ' ' LEU . 9.3 t80 -64.35 -36.52 84.39 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.71 -37.45 76.56 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.963 178.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.29 -34.07 73.24 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 121.203 0.525 . . . . 0.0 109.803 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mt -76.78 -31.44 57.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.04 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 56.7 t -68.59 -36.83 76.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.537 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.02 -49.15 39.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.564 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.76 -41.16 92.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.625 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.402 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 43.1 m -63.62 -50.35 69.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.574 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.58 -42.85 68.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.728 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -69.92 -27.05 64.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.81 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.5 tt -69.83 -49.11 55.73 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.017 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' A' ' 95' ' ' GLN . 7.2 mt -62.32 -50.9 69.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.123 0.487 . . . . 0.0 109.916 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.7 m -56.38 -34.2 66.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.725 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.18 -53.13 21.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.272 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 2.8 pp -68.63 -28.84 67.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.103 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.43 ' HB2' ' O ' ' A' ' 91' ' ' LEU . 10.0 tt0 -63.87 -54.13 39.68 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.864 0.364 . . . . 0.0 110.492 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -67.14 -29.52 69.25 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.58 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.922 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.903 0.382 . . . . 0.0 110.866 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.6 mp -58.57 -32.99 69.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.975 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.8 p -60.51 -47.63 91.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.335 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -59.81 -49.93 75.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.081 0.467 . . . . 0.0 110.349 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.427 HG13 ' CG2' ' A' ' 59' ' ' ILE . 10.7 t -56.85 -40.79 73.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.256 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -64.54 -37.57 94.59 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.479 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -56.86 -43.75 81.52 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.131 0.491 . . . . 0.0 109.897 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.415 HD22 ' CE1' ' A' ' 80' ' ' TYR . 0.2 OUTLIER -63.36 -40.15 96.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.732 178.909 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -53.82 -36.91 63.01 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.04 -42.63 84.48 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.675 178.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.55 -31.19 72.28 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.851 178.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.43 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 1.7 tp -63.58 -50.9 67.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.163 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.21 -34.44 72.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.176 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -45.27 94.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.312 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.452 ' CD1' ' CD2' ' A' ' 91' ' ' LEU . 7.7 m-85 -60.38 -44.1 95.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.232 179.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -57.24 -37.28 72.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.58 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -61.17 -55.15 35.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.362 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 39.5 t -57.82 -37.61 61.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.368 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.41 HG23 HG12 ' A' ' 48' ' ' VAL . 47.5 t -67.34 -43.7 87.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.853 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 m -55.81 -39.57 71.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.723 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.71 -27.74 68.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.031 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 44.2 mt -70.66 -40.27 73.11 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.999 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 63.61 14.16 7.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.41 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -138.42 158.45 44.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.688 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 58.7 30.53 65.88 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.27 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.597 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 1.6 mmtp -54.65 -52.08 73.12 Favored Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.597 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 11.0 Cg_endo -55.03 -49.28 17.13 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.447 2.098 . . . . 0.0 113.316 -179.092 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -59.66 -50.27 74.53 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.54 0.21 . . . . 0.0 111.436 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.571 ' O ' HG13 ' A' ' 52' ' ' ILE . 2.7 t -66.23 -55.39 19.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 120.841 0.353 . . . . 0.0 110.668 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.622 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 73.9 m-20 -52.7 -29.99 29.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.204 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -49.84 38.61 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -71.33 -45.96 61.73 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 48' ' ' VAL . 3.6 mt -57.13 -30.4 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.461 178.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.622 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -69.12 -50.87 44.06 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 178.634 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.4 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 14.7 m-20 -51.29 -38.69 54.21 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.385 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 27.9 mt -70.92 -43.4 68.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.084 179.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -56.65 -36.91 70.06 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.4 ' CD1' ' HA ' ' A' ' 54' ' ' ASN . 10.2 mt -70.98 -41.75 76.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.188 178.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 29.7 t -58.53 -52.1 67.07 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.519 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.427 ' CG2' HG13 ' A' ' 24' ' ' VAL . 36.8 mt -61.5 -52.64 58.73 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.661 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.415 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 1.4 t70 -56.55 -34.84 67.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.311 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.79 -49.22 78.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.852 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.658 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.3 mp -55.62 -56.56 18.87 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.041 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.437 ' H ' ' HG2' ' A' ' 63' ' ' MET . 0.0 OUTLIER -45.73 -54.44 7.89 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.762 0.315 . . . . 0.0 110.841 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.12 -24.44 66.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.918 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.1 mtmt -82.2 -30.06 31.09 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.223 0.535 . . . . 0.0 110.57 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -72.29 -33.74 47.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.983 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.0 mmtt -89.53 -24.11 21.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.051 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.418 ' C ' ' CG2' ' A' ' 69' ' ' THR . 58.3 m -115.38 19.08 15.74 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.418 ' CG2' ' C ' ' A' ' 68' ' ' SER . 0.1 OUTLIER -163.08 166.46 23.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.588 179.196 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -107.3 43.72 1.15 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.567 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -53.71 142.18 24.17 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.174 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.4 m -79.22 148.97 32.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.774 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.77 -31.15 68.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.594 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -59.22 -45.39 91.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.443 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -34.33 75.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.421 179.551 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 23.3 mm -71.49 -33.96 51.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.72 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -63.88 -51.75 63.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.783 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -60.94 -47.09 88.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.743 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -56.44 -33.17 65.6 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.415 ' CE1' HD22 ' A' ' 27' ' ' LEU . 4.6 t80 -64.32 -37.71 88.46 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -69.9 -37.67 76.05 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.15 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.32 -33.54 72.53 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 121.114 0.483 . . . . 0.0 109.873 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.7 mt -77.77 -30.96 51.7 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.05 178.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 52.7 t -69.42 -38.19 76.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.746 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -72.34 -46.93 53.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.732 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 m -68.94 -36.6 78.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.941 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.494 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 58.9 m -69.94 -51.12 35.36 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.039 -179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -55.39 -42.95 74.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.947 0.403 . . . . 0.0 110.797 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -71.31 -28.23 63.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.849 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.417 ' O ' ' CD2' ' A' ' 94' ' ' LEU . 1.5 tt -68.22 -50.21 55.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.297 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 87' ' ' SER . 5.8 mt -63.76 -41.57 97.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.361 0.6 . . . . 0.0 109.715 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.7 m -56.55 -39.79 74.01 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.767 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.83 -54.32 23.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.344 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.417 ' CD2' ' O ' ' A' ' 90' ' ' LEU . 0.3 OUTLIER -63.88 -25.93 68.38 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.798 179.83 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -40.03 77.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.96 0.409 . . . . 0.0 110.128 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.1 mtpt -64.14 -43.52 94.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.012 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.41 ' HG3' ' HA ' ' A' ' 94' ' ' LEU . 12.9 mttm . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.952 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.7 t . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.689 0.28 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -54.84 -32.91 61.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.206 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.5 t -61.97 -52.57 58.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.173 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.69 -45.53 63.52 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.936 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.407 ' CG1' ' CE ' ' A' ' 63' ' ' MET . 30.6 t -60.1 -48.53 87.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.719 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.76 -39.71 98.29 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.011 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.1 m -56.7 -42.15 78.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.022 0.439 . . . . 0.0 110.236 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 20.1 tp -64.71 -41.35 96.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.145 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.7 ttmm -52.81 -39.35 62.32 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -65.05 -42.37 94.32 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.423 178.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.36 -31.6 72.8 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.824 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tt -61.97 -50.37 72.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.068 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -57.74 -38.83 76.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.164 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -57.89 -44.59 86.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.251 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -59.71 -43.19 94.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.394 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -56.48 -40.61 75.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.397 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.88 -52.07 66.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.278 179.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.2 t -59.76 -37.79 73.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.497 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.3 t -67.47 -43.86 87.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.802 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.8 m -61.95 -29.22 70.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.443 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.28 -31.43 71.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.845 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 pp -113.84 79.1 1.21 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.026 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.403 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 6.4 mmtp -46.55 99.23 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.91 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.4 ' HB2' ' O ' ' A' ' 42' ' ' LYS . 33.9 t0 178.22 146.62 0.14 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.919 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . 0.413 ' O ' HG13 ' A' ' 48' ' ' VAL . . . 50.79 42.2 45.42 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.706 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.56 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 7.8 mmtp -59.39 -51.62 80.06 Favored Pre-proline 0 C--N 1.329 -0.303 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.56 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 28.9 Cg_endo -63.78 -42.52 19.75 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.201 1.934 . . . . 0.0 112.943 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -65.15 -50.55 65.54 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.823 0.344 . . . . 0.0 111.193 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.597 ' O ' HG13 ' A' ' 52' ' ' ILE . 14.5 p -63.51 -55.23 24.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.598 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.59 ' HA ' HG13 ' A' ' 52' ' ' ILE . 60.3 m-20 -51.58 -31.2 23.8 Favored 'General case' 0 N--CA 1.461 0.116 0 CA-C-O 120.867 0.365 . . . . 0.0 110.702 179.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.09 -44.77 83.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.322 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -70.95 -48.7 51.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.269 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.597 HG13 ' O ' ' A' ' 48' ' ' VAL . 0.0 OUTLIER -57.46 -41.1 78.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.031 179.442 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -58.36 -52.43 65.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.684 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.0 m-20 -52.04 -39.81 60.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.944 0.402 . . . . 0.0 110.512 179.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 10.5 mt -68.39 -44.44 75.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.594 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.65 -36.38 69.46 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 10.5 mt -71.35 -42.48 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.289 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.8 m -60.4 -52.23 66.13 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.566 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 6.9 mt -58.13 -50.43 78.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.86 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -59.33 -37.16 77.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.813 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.66 -50.0 74.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.997 0.427 . . . . 0.0 110.676 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.657 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.0 OUTLIER -55.72 -55.44 32.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.547 179.372 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.407 ' CE ' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -44.9 -54.61 6.27 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.263 -179.848 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.78 -25.93 66.9 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.678 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.6 mtmp? -82.11 -29.49 31.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.024 0.44 . . . . 0.0 110.697 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.3 mm -73.12 -33.94 43.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.28 -179.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 14.3 mmtm -93.03 1.02 57.48 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.417 ' C ' ' CG2' ' A' ' 69' ' ' THR . 17.0 m -147.23 21.76 1.21 Allowed 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.417 ' CG2' ' C ' ' A' ' 68' ' ' SER . 0.2 OUTLIER -161.85 158.6 25.75 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.752 179.362 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -97.39 43.52 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.318 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.4 129.13 21.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.341 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.4 m -71.36 137.83 48.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.578 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.84 -30.29 22.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.717 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -59.34 -43.92 92.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.377 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 15.1 tp60 -68.05 -33.97 75.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.417 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 22.8 mm -69.58 -39.46 78.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.498 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -41.35 96.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.669 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.25 -48.24 68.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.453 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -56.57 -34.25 66.96 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -65.04 -36.81 85.55 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.407 -0.961 . . . . 0.0 108.407 177.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -69.84 -37.62 76.24 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.775 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.94 -33.61 72.13 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.0 mt -76.88 -32.39 57.44 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.105 179.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 43.2 t -69.52 -36.66 72.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.495 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.4 mmtm -72.13 -42.66 65.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.566 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.91 -35.65 64.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.492 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.42 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 34.8 m -68.59 -50.61 50.32 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.645 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -60.19 -38.7 84.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.323 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -65.85 -32.86 74.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.235 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.7 tt -64.66 -44.07 91.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.667 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.0 mt -62.09 -43.54 98.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.789 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 57.9 m -54.66 -46.68 74.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.449 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.3 -40.71 97.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.415 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 mp -57.72 -49.75 75.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.56 179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.83 -42.33 75.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.592 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.13 -38.6 80.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.571 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.2 mttt . . . . . 0 C--N 1.33 -0.261 0 CA-C-O 121.371 0.605 . . . . 0.0 111.069 179.876 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.2 p . . . . . 0 C--O 1.23 0.047 0 CA-C-O 120.872 0.368 . . . . 0.0 110.829 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.6 mt -54.6 -32.76 59.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.95 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.9 p -59.13 -47.06 91.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.022 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.6 tttt -61.54 -41.98 98.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.077 0.465 . . . . 0.0 110.3 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.8 t -57.03 -44.88 83.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.49 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.17 -37.69 94.92 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.711 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.44 -44.57 84.82 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.895 0.378 . . . . 0.0 110.222 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 20.0 tp -62.65 -41.79 99.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.088 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.3 tptt -53.28 -38.5 63.15 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.9 mptt -65.15 -40.67 94.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.32 178.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -63.44 -31.32 72.45 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.739 178.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.4 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.2 OUTLIER -63.09 -49.09 75.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.103 179.143 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -59.48 -37.0 77.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.315 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -50.24 73.56 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.332 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.448 ' CD1' ' CD2' ' A' ' 91' ' ' LEU . 4.1 m-85 -58.78 -45.51 89.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.619 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -51.56 -43.8 62.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.02 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -61.43 -53.92 50.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.566 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 33.5 t -58.63 -37.7 66.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.767 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.407 ' CG2' ' CD2' ' A' ' 94' ' ' LEU . 39.3 t -71.08 -40.46 75.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.081 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.44 -38.39 77.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.86 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.32 -20.05 63.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.436 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 44.4 mt -75.33 -42.48 54.29 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.211 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.61 14.0 7.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.439 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -131.68 146.53 52.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.704 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 57.22 27.93 58.22 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.334 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.621 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 0.6 OUTLIER -61.92 -49.33 86.08 Favored Pre-proline 0 C--N 1.329 -0.313 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.716 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.621 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 10.8 Cg_endo -55.0 -45.48 40.59 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.146 1.897 . . . . 0.0 112.954 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.439 ' O ' ' HG3' ' A' ' 50' ' ' ARG . 11.8 pt-20 -70.06 -50.73 38.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.768 0.318 . . . . 0.0 111.479 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.598 ' O ' HG13 ' A' ' 52' ' ' ILE . 8.3 p -62.04 -55.29 25.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.718 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.573 ' HA ' HG13 ' A' ' 52' ' ' ILE . 98.2 m-20 -51.59 -43.79 62.58 Favored 'General case' 0 N--CA 1.463 0.204 0 O-C-N 123.078 0.236 . . . . 0.0 111.399 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.517 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -60.78 -36.04 77.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.773 0.32 . . . . 0.0 110.682 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.517 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 44.6 mt-30 -74.42 -48.57 26.87 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.219 0.533 . . . . 0.0 109.973 179.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.598 HG13 ' O ' ' A' ' 48' ' ' VAL . 0.0 OUTLIER -57.56 -38.86 66.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.923 179.319 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.423 ' O ' HG13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -61.45 -53.2 59.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.597 179.507 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.402 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 17.6 m-20 -51.54 -36.52 45.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.786 0.327 . . . . 0.0 110.724 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.7 mt -72.93 -45.54 57.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.82 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.433 ' HG3' ' N ' ' A' ' 57' ' ' ILE . 0.4 OUTLIER -56.74 -33.11 66.23 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.779 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.433 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 14.5 mt -71.26 -44.19 73.51 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.188 178.311 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.1 m -59.11 -46.67 87.71 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.377 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.7 mt -58.46 -55.07 24.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.732 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -57.9 -33.73 69.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.543 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.84 -49.97 74.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.206 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.665 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.0 OUTLIER -55.89 -54.64 42.14 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.264 179.045 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.03 -54.95 6.04 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.255 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.27 -25.17 66.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.649 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 24.1 mtpt -82.29 -29.97 30.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.166 0.508 . . . . 0.0 110.62 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.665 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -71.99 -34.06 49.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.092 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.64 1.16 55.56 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.238 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 58.3 m -138.87 21.91 2.65 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.3 p -160.16 179.61 8.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.869 0.366 . . . . 0.0 110.73 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.58 37.36 3.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.565 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 16.7 mmm -56.0 146.18 23.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.125 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.2 m -84.97 142.41 29.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.755 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.99 -29.81 57.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.707 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -46.39 89.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.451 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.46 -34.23 75.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.436 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.431 HG22 HD12 ' A' ' 76' ' ' ILE . 27.0 mm -70.58 -33.87 55.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.77 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 8.4 tp60 -66.46 -42.65 87.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.872 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.59 -50.9 56.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.72 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -56.37 -34.09 66.33 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -64.55 -35.65 81.66 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -69.55 -37.52 77.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.963 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.25 -37.27 77.15 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.313 0.578 . . . . 0.0 109.589 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 26.3 mt -75.51 -30.71 59.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.101 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 61.7 t -69.17 -34.57 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.53 179.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.16 -49.11 38.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.464 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 m -68.1 -36.85 80.45 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.568 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.0 t -66.64 -50.33 63.3 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.811 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -58.79 -36.0 73.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.487 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.19 -31.42 68.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.73 179.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.5 tt -66.34 -49.05 68.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.993 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.448 ' CD2' ' CD1' ' A' ' 34' ' ' PHE . 7.0 mt -60.71 -49.09 78.89 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.143 0.497 . . . . 0.0 109.848 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.2 m -55.73 -42.72 75.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.662 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.77 -52.25 63.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.685 179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.407 ' CD2' ' CG2' ' A' ' 38' ' ' VAL . 4.6 mp -57.45 -42.68 82.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.756 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -55.59 -43.88 76.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.611 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.7 mtmt -66.35 -29.64 69.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.031 0.443 . . . . 0.0 109.835 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.6 mttt . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.458 -179.96 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.4 p . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.769 0.319 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.9 mt -54.69 -32.89 60.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.161 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.0 p -63.98 -46.5 93.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.412 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.8 mttm -56.73 -50.52 71.96 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.019 0.438 . . . . 0.0 110.674 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.5 t -57.04 -39.96 69.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.116 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.1 -37.15 93.81 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.595 179.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.1 m -57.02 -47.28 81.28 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.078 0.466 . . . . 0.0 110.084 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.417 HD12 ' CE1' ' A' ' 80' ' ' TYR . 4.1 tt -61.53 -38.7 88.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.818 179.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -54.92 -37.8 66.84 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 178.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.0 -41.85 95.0 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.33 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.26 -30.48 71.62 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.795 178.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.412 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.3 OUTLIER -63.0 -52.35 63.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.101 179.312 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -57.93 -36.06 71.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.076 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.99 -44.55 91.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.244 179.305 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.412 ' CD2' ' HA ' ' A' ' 31' ' ' LEU . 13.1 m-85 -61.18 -43.37 98.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.346 179.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.8 m-20 -54.09 -44.67 71.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.534 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -59.26 -54.32 48.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.062 0.458 . . . . 0.0 110.439 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.4 t -55.89 -37.78 49.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.49 179.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.435 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 48.8 t -69.58 -40.86 80.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.618 179.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.8 t -63.72 -23.29 67.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.334 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.05 -38.75 92.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.564 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.435 ' CD2' ' HA ' ' A' ' 38' ' ' VAL . 0.5 OUTLIER -88.81 -34.23 17.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.682 0.277 . . . . 0.0 111.23 -179.836 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.86 10.02 6.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.756 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -103.76 103.28 13.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.78 0.324 . . . . 0.0 111.071 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 101.11 53.67 1.0 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.575 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.505 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 2.2 mmtt -66.69 -57.27 12.28 Favored Pre-proline 0 C--N 1.327 -0.388 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.505 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 13.8 Cg_endo -56.88 -49.47 14.39 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.47 2.113 . . . . 0.0 112.974 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.27 -50.14 72.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.826 0.346 . . . . 0.0 111.213 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 52' ' ' ILE . 50.7 t -64.59 -55.57 20.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.706 179.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.42 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 85.3 m-20 -55.46 -25.57 37.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.092 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.32 -49.44 34.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.861 0.362 . . . . 0.0 111.585 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -76.62 -44.56 33.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.492 0.663 . . . . 0.0 109.753 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.8 mt -57.62 -35.34 50.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.337 179.096 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -69.4 -51.71 33.91 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.591 179.283 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.433 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 16.4 m-20 -50.99 -34.46 29.2 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.712 0.291 . . . . 0.0 110.513 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.7 mt -75.81 -43.49 45.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.315 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.86 -36.41 70.01 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.433 ' CD1' ' HA ' ' A' ' 54' ' ' ASN . 12.2 mt -68.51 -40.73 82.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 114.937 -1.028 . . . . 0.0 109.946 178.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.8 m -57.48 -45.62 84.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.482 179.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.6 mt -60.23 -50.72 79.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.398 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.431 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 72.7 m-20 -57.08 -31.68 65.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.166 179.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.25 -49.32 74.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.672 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.663 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.6 mp -56.16 -56.99 14.17 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.023 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.431 ' CG ' ' HA ' ' A' ' 60' ' ' ASP . 0.0 OUTLIER -46.44 -50.72 16.4 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.7 0.286 . . . . 0.0 110.841 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.07 -24.44 67.7 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.753 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.9 mtpt -82.45 -29.36 30.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.113 0.482 . . . . 0.0 110.557 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.663 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -73.07 -37.13 52.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.201 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 5.5 mmmt -93.96 -27.46 16.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.542 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.429 ' O ' ' CG2' ' A' ' 69' ' ' THR . 1.2 t -105.67 24.96 11.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.699 0.285 . . . . 0.0 111.411 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.429 ' CG2' ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 174.66 155.06 0.14 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.887 179.746 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 5.9 mtm -107.73 69.27 0.73 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.907 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 9.2 ptm -72.11 173.29 8.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.791 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.43 141.96 28.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.066 -179.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.08 -29.89 67.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.714 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -58.01 -40.25 80.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.725 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -35.04 79.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.52 179.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 27.0 mm -67.96 -37.54 78.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.833 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 4.0 tp60 -66.68 -52.12 48.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.853 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -45.67 85.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.731 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -56.56 -35.13 67.81 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.417 ' CE1' HD12 ' A' ' 27' ' ' LEU . 11.2 t80 -64.21 -38.08 89.76 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 177.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -69.97 -35.79 74.72 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.09 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.42 79.2 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.242 0.544 . . . . 0.0 109.75 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.5 mt -74.45 -31.25 62.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.045 178.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 61.4 t -69.57 -38.99 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.356 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -66.13 -49.14 68.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.377 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 74.7 m -68.27 -38.06 81.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.407 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.424 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 24.3 m -65.7 -50.37 65.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.692 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.89 -43.58 73.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.985 0.421 . . . . 0.0 110.728 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -67.56 -29.12 68.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.707 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.1 tt -67.92 -48.89 64.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.064 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 87' ' ' SER . 7.0 mt -61.03 -52.44 64.94 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.057 0.456 . . . . 0.0 110.076 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.4 m -58.58 -38.32 77.66 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.662 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.25 -36.06 76.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.875 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.23 -42.42 72.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.856 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.01 -54.25 49.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.686 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.6 mtpp -63.78 -28.9 70.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.37 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.5 tttp . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.161 -179.968 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.2 t . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.831 0.348 . . . . 0.0 110.799 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.5 -32.73 72.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.933 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.5 p -61.18 -47.98 91.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.254 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.45 -37.91 79.36 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.912 0.387 . . . . 0.0 110.589 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 19.8 t -58.67 -50.61 78.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.395 179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.15 -40.45 97.23 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.644 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.633 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -57.02 -37.99 72.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.08 0.466 . . . . 0.0 110.022 179.292 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.97 -42.83 94.23 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 178.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.75 -35.78 56.74 Favored 'General case' 0 C--N 1.333 -0.128 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.633 ' HG3' ' HA ' ' A' ' 26' ' ' THR . 23.2 mttt -61.69 -45.64 93.1 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.592 178.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -36.96 71.55 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.316 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.1 mp -61.36 -51.2 69.8 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.491 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -57.94 -37.04 73.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.296 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.8 tptt -58.86 -43.2 90.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.263 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.446 ' CE1' ' CD2' ' A' ' 91' ' ' LEU . 13.0 m-85 -63.91 -41.39 97.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.612 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 45.5 m-20 -55.19 -44.19 75.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.872 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -62.72 -54.29 41.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.766 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 33.7 t -57.71 -38.22 63.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.06 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 47.9 t -75.07 -35.45 34.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.885 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.4 p -60.78 -34.02 73.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.531 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.11 -21.42 59.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.269 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.5 mt -71.45 -41.28 69.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.93 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.67 13.81 7.66 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.567 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -131.06 135.56 47.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.92 0.391 . . . . 0.0 110.898 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 59.05 57.27 20.73 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.488 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.498 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 3.7 mmmm -77.45 -45.09 2.62 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 120.508 0.194 . . . . 0.0 111.348 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.498 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 50.2 Cg_exo -53.68 -42.36 66.75 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.256 1.971 . . . . 0.0 112.475 -179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -60.64 -50.23 74.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.921 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.532 ' O ' HG13 ' A' ' 52' ' ' ILE . 5.1 t -65.92 -55.21 20.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.082 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.596 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 97.4 m-20 -52.85 -31.11 37.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.362 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 26.4 ttm180 -73.06 -47.89 40.74 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -73.01 -41.27 64.44 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.621 0.724 . . . . 0.0 109.41 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.532 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.4 mt -61.87 -31.54 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.082 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.596 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -70.16 -55.05 10.35 Favored 'General case' 0 N--CA 1.46 0.055 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.366 179.54 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.426 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 28.5 p30 -59.83 -25.42 64.98 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.989 -179.512 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 71.9 mt -77.54 -46.74 21.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.514 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.49 ' HG3' ' N ' ' A' ' 57' ' ' ILE . 0.1 OUTLIER -57.0 -32.88 66.57 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.957 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.49 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 13.6 mt -71.4 -41.43 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.063 178.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 69.1 m -57.46 -47.6 81.42 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.214 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 11.7 mt -59.78 -49.83 82.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.271 179.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.79 -32.58 71.92 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.114 179.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.83 -49.86 75.22 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.96 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.655 ' O ' HG12 ' A' ' 66' ' ' ILE . 0.8 OUTLIER -55.72 -53.62 54.41 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.2 178.89 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.28 -56.44 4.87 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.018 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.62 -24.07 65.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.607 179.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.07 -29.19 31.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.233 0.539 . . . . 0.0 110.415 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.655 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.8 mm -73.46 -41.11 56.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.499 -179.302 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.75 -29.51 16.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.875 -179.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.413 ' O ' ' CG2' ' A' ' 69' ' ' THR . 0.8 OUTLIER -102.32 24.23 10.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.693 0.282 . . . . 0.0 111.713 -179.387 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.413 ' CG2' ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 177.57 149.82 0.18 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.935 179.523 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.4 mtm -76.06 63.22 1.77 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.957 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.51 125.77 25.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.788 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.1 m -78.11 135.54 37.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.799 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.86 -33.71 50.98 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.871 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.39 -47.51 83.64 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.347 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.15 -32.92 74.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.353 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.475 HG22 HD13 ' A' ' 76' ' ' ILE . 26.1 mm -71.58 -38.69 68.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.695 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -52.18 66.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.634 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.58 -47.04 80.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.485 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -56.54 -34.06 66.71 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -64.24 -37.26 86.86 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -69.67 -36.7 76.26 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.978 178.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.49 -36.07 75.34 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.146 0.498 . . . . 0.0 109.688 179.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.2 mt -76.74 -31.25 56.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.004 178.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 54.0 t -69.55 -34.83 63.49 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.466 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.8 tptp -71.99 -49.26 38.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.408 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 11.6 m -66.71 -43.7 83.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.406 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 98.5 p -61.51 -48.46 80.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.505 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -55.28 -41.04 71.73 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.702 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.98 -34.36 78.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.602 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 tt -63.36 -46.3 87.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.791 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.446 ' CD2' ' CE1' ' A' ' 34' ' ' PHE . 6.3 mt -63.75 -47.47 80.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.129 0.49 . . . . 0.0 109.825 179.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 33.8 p -56.52 -39.51 73.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.564 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.99 -47.03 75.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.592 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 85.7 mt -57.2 -44.78 83.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.632 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -39.85 86.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.368 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.4 mttt -64.22 -29.15 70.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.853 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.227 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.309 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 120.84 0.352 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 20.4 mt -54.01 -33.0 55.96 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.074 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.3 p -60.78 -45.91 97.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.042 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 80' ' ' TYR . 0.1 OUTLIER -60.44 -46.81 88.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.058 0.456 . . . . 0.0 110.587 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.419 ' CG1' ' HE2' ' A' ' 63' ' ' MET . 19.4 t -56.97 -44.78 83.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.419 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.89 -36.41 92.78 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.707 -0.759 . . . . 0.0 111.68 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.3 m -57.98 -47.51 82.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.913 0.387 . . . . 0.0 110.186 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 12.8 mt -60.84 -39.04 87.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.078 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.55 -40.62 68.88 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.57 -37.23 86.84 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.387 178.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.405 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -62.04 -33.4 74.3 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.726 178.979 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.4 mt -65.26 -48.86 71.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.022 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -57.75 -42.06 83.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.195 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.4 tptt -61.08 -41.93 97.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.047 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.429 ' CE2' HD22 ' A' ' 91' ' ' LEU . 4.0 m-30 -60.73 -45.44 94.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.366 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 12.6 m-20 -58.65 -36.45 74.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.615 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -61.42 -55.29 32.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.479 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 36.6 t -58.97 -37.93 70.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.67 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.3 t -70.82 -37.79 70.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.871 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.56 -36.88 79.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.426 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.34 -12.77 60.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.387 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 52.3 mt -85.98 -55.52 3.91 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.965 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.13 3.73 4.44 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.649 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -114.09 126.64 55.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.781 0.324 . . . . 0.0 110.692 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.89 31.93 54.59 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.326 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.522 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 6.8 mmtt -48.1 -57.31 10.72 Favored Pre-proline 0 C--N 1.331 -0.236 0 N-CA-C 111.606 0.224 . . . . 0.0 111.606 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.522 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 10.6 Cg_endo -54.1 -49.19 17.9 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.524 2.149 . . . . 0.0 112.513 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -53.34 -49.71 66.55 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.017 0.437 . . . . 0.0 111.264 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.632 ' O ' HG13 ' A' ' 52' ' ' ILE . 2.5 t -67.64 -55.23 17.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.92 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.563 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 79.5 m-20 -52.66 -35.7 55.48 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.485 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 11.6 ptt85 -73.65 -38.96 64.82 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.485 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 61.7 mt-30 -75.94 -47.75 23.95 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.731 0.777 . . . . 0.0 109.163 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.632 HG13 ' O ' ' A' ' 48' ' ' VAL . 3.6 mt -57.03 -32.14 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 114.555 -1.202 . . . . 0.0 110.09 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.563 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.4 OUTLIER -69.13 -52.99 22.54 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.418 179.011 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.1 m-20 -50.99 -34.31 28.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.875 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 26.4 mt -76.0 -45.96 31.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.96 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.455 ' HG3' ' N ' ' A' ' 57' ' ' ILE . 0.4 OUTLIER -56.65 -31.91 64.83 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.915 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.455 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 16.8 mt -71.34 -44.79 72.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.055 178.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.6 m -60.27 -52.41 65.39 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.355 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 71.6 mt -58.24 -51.43 71.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.585 179.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.16 -33.52 71.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.206 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.64 -49.49 76.28 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.962 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.662 ' O ' HG12 ' A' ' 66' ' ' ILE . 0.8 OUTLIER -55.33 -52.51 63.24 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.16 178.912 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.419 ' HE2' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -44.96 -58.55 3.08 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.02 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.24 -24.2 62.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.576 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.18 -29.66 31.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.141 0.496 . . . . 0.0 110.562 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.662 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.2 mm -70.49 -40.45 77.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.237 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.27 1.23 51.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.17 -179.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.5 m -132.95 21.18 4.13 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 120.748 -0.381 . . . . 0.0 112.018 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -160.34 -175.34 4.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.858 0.361 . . . . 0.0 110.833 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -126.55 33.42 4.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.392 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.1 mmm -56.91 149.98 17.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.999 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.7 m -80.67 143.94 32.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.904 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.81 -30.77 58.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.64 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -58.08 -46.26 85.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.39 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.06 -35.68 73.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.203 179.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.449 HD13 HG22 ' A' ' 76' ' ' ILE . 18.4 mm -69.54 -33.97 59.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.489 179.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' A' ' 80' ' ' TYR . 8.0 tp-100 -61.83 -49.44 76.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.468 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 mmtt -62.59 -41.61 99.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.273 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -57.69 -36.22 71.67 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 14.5 m-85 -64.32 -35.9 82.38 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 177.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -69.44 -37.58 77.43 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.026 178.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.46 -34.62 75.76 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.24 0.543 . . . . 0.0 109.61 178.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.4 mt -76.87 -30.26 56.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.06 178.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 66.4 t -68.12 -35.76 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.41 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.7 tptt -72.44 -49.26 34.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.599 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.9 m -66.03 -43.11 88.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.518 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 96.3 p -62.38 -46.7 87.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.525 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -55.94 -41.26 74.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.634 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.96 -32.12 73.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.704 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.408 HD21 ' CE2' ' A' ' 34' ' ' PHE . 7.9 tt -63.97 -47.8 78.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.046 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.429 HD22 ' CE2' ' A' ' 34' ' ' PHE . 7.6 mt -60.59 -52.55 64.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.109 0.481 . . . . 0.0 109.925 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 69.8 m -54.93 -38.63 67.91 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.487 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.412 ' HA ' ' HG2' ' A' ' 96' ' ' LYS . . . -68.93 -36.17 77.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.621 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.9 tp -66.29 -49.06 68.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.745 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -55.92 -48.92 74.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.613 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.412 ' HG2' ' HA ' ' A' ' 93' ' ' ALA . 9.0 pttt -62.84 -28.62 70.14 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.167 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.599 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.738 0.304 . . . . 0.0 111.025 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 5.0 mt -53.78 -32.84 53.97 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.061 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.6 p -67.8 -45.15 84.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.97 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? -63.43 -52.98 59.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.928 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.408 HG11 ' CE ' ' A' ' 63' ' ' MET . 23.7 t -56.76 -46.97 83.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.578 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -58.83 -40.22 94.84 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.511 -0.852 . . . . 0.0 111.419 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 48.4 m -57.18 -38.96 74.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.063 0.459 . . . . 0.0 109.925 179.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 15.8 tp -62.84 -44.06 97.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.878 179.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.95 -39.6 63.03 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -36.2 83.55 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.582 178.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.43 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -65.62 -33.61 76.3 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.876 179.024 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.96 -42.02 94.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.945 179.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.28 -49.39 77.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.832 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.451 ' HG3' ' N ' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -57.86 -35.78 71.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.823 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.451 ' N ' ' HG3' ' A' ' 33' ' ' LYS . 15.7 m-85 -65.62 -39.87 91.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.891 0.376 . . . . 0.0 110.411 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -61.33 -40.61 94.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.379 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -53.66 54.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.363 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.6 t -57.54 -37.96 61.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.723 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 77.2 t -71.18 -39.41 73.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.892 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.84 -37.16 75.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.74 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.76 -17.98 65.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.426 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 24.4 mt -79.93 -34.64 38.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.148 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER 64.77 12.69 7.87 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.476 -179.741 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -133.82 155.28 50.11 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.814 0.34 . . . . 0.0 110.766 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 57.8 27.79 59.6 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.32 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.515 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 1.1 mmtt -55.73 -57.21 22.69 Favored Pre-proline 0 C--N 1.329 -0.306 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 11.7 Cg_endo -55.69 -49.09 16.96 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.428 2.085 . . . . 0.0 112.68 -179.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -55.49 -48.95 73.78 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.069 0.461 . . . . 0.0 111.074 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.578 ' O ' HG13 ' A' ' 52' ' ' ILE . 18.8 t -67.19 -50.06 66.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.256 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -59.06 -33.09 70.38 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.484 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 8.1 ptp180 -73.51 -40.21 64.21 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.442 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.484 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 31.7 mt-30 -75.98 -49.77 16.74 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.578 HG13 ' O ' ' A' ' 48' ' ' VAL . 2.0 mt -56.89 -29.91 32.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.005 178.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.462 ' HA ' ' HG2' ' A' ' 56' ' ' GLU . 32.2 tttt -69.26 -53.17 21.16 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.159 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.405 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 8.4 m-20 -53.17 -32.39 47.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.843 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 55.6 mt -74.51 -47.82 30.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.305 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.462 ' HG2' ' HA ' ' A' ' 53' ' ' LYS . 3.5 pt-20 -56.21 -31.79 63.8 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.413 HG13 ' O ' ' A' ' 53' ' ' LYS . 15.6 mt -71.04 -43.26 76.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.897 178.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m -58.48 -46.96 85.57 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.255 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.401 ' CG2' HG11 ' A' ' 24' ' ' VAL . 55.5 mt -60.08 -55.56 23.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.458 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.2 -34.12 68.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.245 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.8 -49.17 76.14 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.197 0.522 . . . . 0.0 109.899 179.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.677 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.2 mp -55.09 -48.77 73.1 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.867 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.408 ' CE ' HG11 ' A' ' 24' ' ' VAL . 12.5 mmt -44.85 -59.84 2.34 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.764 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.94 -23.58 61.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.589 179.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.405 ' O ' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -82.03 -29.0 32.19 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.293 0.568 . . . . 0.0 110.538 179.37 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.677 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.3 mm -73.41 -45.7 51.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.913 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.3 -32.43 17.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.013 -178.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.431 ' O ' ' CG2' ' A' ' 69' ' ' THR . 0.3 OUTLIER -98.08 22.18 9.78 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.233 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.431 ' CG2' ' O ' ' A' ' 68' ' ' SER . 0.6 OUTLIER 179.36 149.75 0.29 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.817 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -78.9 61.2 3.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.951 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.07 120.59 10.57 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.806 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.2 m -65.32 132.71 49.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.774 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.34 -31.51 54.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.83 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -61.33 -45.75 93.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.437 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.42 -33.72 75.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.424 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.45 HD13 HG21 ' A' ' 76' ' ' ILE . 20.9 mm -68.53 -33.88 62.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.787 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -67.8 -48.69 65.58 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.856 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -49.02 70.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.578 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -56.61 -33.54 66.35 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 178.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -64.89 -35.62 81.73 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 177.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -69.54 -37.05 76.92 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.93 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.5 -35.38 75.8 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 121.28 0.562 . . . . 0.0 109.633 178.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.1 mt -75.51 -31.57 60.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.082 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 75.6 t -67.71 -34.64 69.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.386 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? -72.15 -49.42 36.01 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.277 179.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 69.6 m -63.4 -41.67 98.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.18 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.1 t -62.94 -50.0 72.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.321 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -50.59 -42.37 55.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.564 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -70.64 -29.17 65.46 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.636 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 tt -67.86 -49.23 63.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.948 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.45 ' CD2' ' CE1' ' A' ' 34' ' ' PHE . 6.8 mt -61.78 -46.64 88.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.128 0.49 . . . . 0.0 109.797 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 12.1 p -54.94 -42.52 72.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.452 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.84 -47.33 81.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.348 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 mt -59.03 -45.15 91.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.439 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -55.83 -39.39 71.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.333 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.12 -30.84 70.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.818 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 43.6 mttt . . . . . 0 C--N 1.331 -0.201 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.958 179.727 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.884 0.373 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.0 mt -60.14 -32.86 71.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.86 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 40.4 t -59.83 -52.33 62.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.096 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -53.76 -46.41 70.92 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.009 0.433 . . . . 0.0 110.657 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.4 ' CG1' ' CE ' ' A' ' 63' ' ' MET . 10.7 t -59.45 -43.24 90.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.436 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.93 -36.26 91.84 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.604 -0.808 . . . . 0.0 111.763 179.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -49.06 76.98 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.98 0.419 . . . . 0.0 110.218 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.412 ' HG ' ' CE2' ' A' ' 80' ' ' TYR . 6.6 mt -62.16 -38.8 90.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.945 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -53.68 -37.79 63.56 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.42 -40.53 81.17 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.793 178.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -62.54 -36.91 84.11 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.046 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -62.61 -48.42 79.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.256 179.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -59.99 -35.07 74.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.361 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -60.59 -46.08 91.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.341 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -62.59 -41.16 98.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.415 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -57.84 -38.22 75.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.885 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.11 -54.39 30.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.554 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 29.1 t -58.33 -38.24 68.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.779 179.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 45.2 t -74.99 -35.83 36.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.882 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.1 m -59.91 -34.88 73.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.633 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.55 -16.44 60.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.301 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.416 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 82.6 mt -75.51 -45.97 35.07 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.127 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 1.4 mptt 68.31 8.43 6.6 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.53 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -127.38 150.15 49.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.716 0.293 . . . . 0.0 110.684 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 57.16 34.03 65.98 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.267 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.513 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 3.8 mmtp -63.01 -44.3 84.49 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.423 0.154 . . . . 0.0 111.389 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.513 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 32.2 Cg_exo -58.78 -49.18 12.22 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.495 2.13 . . . . 0.0 112.864 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -64.59 -50.09 68.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.734 0.302 . . . . 0.0 111.704 -179.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.564 ' O ' HG13 ' A' ' 52' ' ' ILE . 14.7 p -66.88 -46.75 84.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.186 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -60.24 -28.98 68.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.833 0.349 . . . . 0.0 110.759 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 20.9 ttt-85 -74.16 -47.11 38.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.42 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -72.37 -46.15 56.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.607 0.717 . . . . 0.0 109.268 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.2 mt -57.48 -39.45 68.97 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-N 114.646 -1.161 . . . . 0.0 110.459 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.46 ' O ' HG12 ' A' ' 57' ' ' ILE . 1.2 tmtt? -64.34 -47.78 78.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.592 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.452 ' HA ' HG12 ' A' ' 57' ' ' ILE . 14.2 m-20 -51.5 -49.18 62.37 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.707 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.2 mt -58.98 -40.73 85.7 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -29.68 63.48 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.164 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 53' ' ' LYS . 5.3 mm -71.19 -43.52 74.81 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.236 178.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 28.3 t -57.94 -52.98 63.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.666 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.4 mt -58.38 -52.79 54.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.943 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.53 -36.47 71.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.492 179.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.99 -49.31 76.15 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.37 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.663 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.7 mp -55.21 -52.51 63.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.537 179.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.4 ' CE ' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.03 -55.93 5.12 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.131 179.853 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.53 -24.28 66.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.65 179.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.407 ' O ' ' OG1' ' A' ' 69' ' ' THR . 9.3 mtpt -82.06 -29.06 32.06 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-O 121.135 0.493 . . . . 0.0 110.488 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.663 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.1 mm -71.64 -39.5 69.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.225 -179.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -93.11 -28.28 16.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.695 -179.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.417 ' O ' ' CG2' ' A' ' 69' ' ' THR . 0.3 OUTLIER -103.73 24.25 11.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.759 0.314 . . . . 0.0 111.753 -179.553 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.417 ' CG2' ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 176.92 150.09 0.15 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.057 179.488 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 1.9 mpp? -76.01 69.69 2.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.991 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.57 125.65 27.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.774 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.65 142.89 33.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.794 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.66 -35.12 60.68 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.938 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -59.28 -47.3 85.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.682 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -59.92 -32.48 70.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.465 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.434 HD12 HG23 ' A' ' 76' ' ' ILE . 26.9 mm -72.0 -34.27 50.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.702 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.22 -46.04 85.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.684 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -49.24 66.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.549 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -56.5 -34.35 66.89 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.412 ' CE2' ' HG ' ' A' ' 27' ' ' LEU . 16.9 t80 -64.73 -35.34 80.73 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 177.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -69.26 -37.52 77.98 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.954 178.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.19 -36.9 78.66 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 178.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mt -75.48 -30.48 59.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.948 178.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 93.2 t -67.88 -35.0 70.65 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.288 179.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.02 -49.38 37.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.206 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.9 -34.7 79.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.129 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.405 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 3.2 m -65.25 -46.35 80.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.286 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -56.36 -44.93 80.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.593 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -65.56 -30.68 71.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.689 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.423 ' CD1' HG12 ' A' ' 52' ' ' ILE . 6.3 tt -64.26 -49.2 72.8 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.875 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 87' ' ' SER . 5.7 mt -60.67 -44.27 96.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.206 0.527 . . . . 0.0 110.018 179.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.52 -40.22 71.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.95 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.22 -53.7 34.01 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.083 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 67.2 mt -60.07 -38.17 82.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.736 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -54.2 48.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.909 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -56.42 -38.89 72.19 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.029 0.442 . . . . 0.0 110.314 179.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.886 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.53 0.206 0 CA-C-O 120.67 0.271 . . . . 0.0 111.098 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.7 mt -54.05 -32.83 55.74 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.098 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.1 p -65.79 -47.84 84.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.251 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HG2' ' CE2' ' A' ' 80' ' ' TYR . 0.1 OUTLIER -59.42 -53.35 59.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.167 0.508 . . . . 0.0 110.519 179.726 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.407 HG11 ' CE ' ' A' ' 63' ' ' MET . 3.8 t -56.79 -39.04 61.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.058 179.132 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -63.75 -37.29 94.47 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.596 -0.811 . . . . 0.0 111.158 178.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.5 m -57.09 -44.85 83.57 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 178.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.75 -37.75 85.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.701 178.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.74 -40.33 69.2 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.82 -37.84 88.96 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.25 178.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.58 -34.31 77.54 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.861 179.066 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.447 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 9.4 mt -62.59 -50.26 71.98 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.958 179.275 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -57.81 -38.24 75.2 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.218 179.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.4 tptt -57.68 -44.56 85.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.295 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.447 ' CD2' ' HA ' ' A' ' 31' ' ' LEU . 4.7 m-85 -61.22 -39.86 91.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.083 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -56.36 -43.72 79.42 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.355 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -59.9 -54.47 45.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.505 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.8 t -56.42 -37.88 53.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.687 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.5 t -71.79 -37.68 63.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.816 179.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 t -58.01 -37.25 73.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.36 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.47 -20.45 60.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.035 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.2 mt -81.73 -28.42 33.38 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.953 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.5 -75.18 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.999 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -57.82 157.04 7.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.998 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 58.57 54.78 34.96 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.512 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.44 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -87.19 -49.68 0.46 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.578 0.228 . . . . 0.0 111.324 -179.737 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 52.5 Cg_exo -53.38 -41.88 69.64 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.556 2.17 . . . . 0.0 112.647 -179.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -56.62 -50.36 72.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.967 0.413 . . . . 0.0 110.888 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.567 ' O ' HG13 ' A' ' 52' ' ' ILE . 2.1 t -64.34 -56.13 17.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.613 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.448 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 49.0 m-80 -54.82 -25.44 28.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.07 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.16 -48.65 41.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.851 0.357 . . . . 0.0 111.5 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -77.19 -45.3 27.11 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-O 121.409 0.623 . . . . 0.0 109.815 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.567 HG13 ' O ' ' A' ' 48' ' ' VAL . 4.0 mt -57.77 -35.73 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.592 179.039 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.492 ' O ' HG12 ' A' ' 57' ' ' ILE . 2.9 tmtm? -69.88 -54.25 14.32 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.329 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.497 ' HA ' HG12 ' A' ' 57' ' ' ILE . 27.2 p30 -60.74 -30.77 70.2 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.524 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.44 ' N ' ' OD1' ' A' ' 54' ' ' ASN . 75.2 mt -72.02 -38.94 69.49 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.23 -31.13 68.77 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.497 HG12 ' HA ' ' A' ' 54' ' ' ASN . 4.8 mm -68.09 -43.64 85.1 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.294 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.691 178.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.1 t -58.56 -51.34 70.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.341 179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 57.3 mt -61.69 -53.4 48.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.658 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.43 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 0.4 OUTLIER -55.17 -32.7 62.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.293 179.434 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.14 -49.23 75.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.761 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.658 ' O ' HG12 ' A' ' 66' ' ' ILE . 0.9 OUTLIER -56.4 -57.3 12.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.069 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.43 ' CG ' ' HA ' ' A' ' 60' ' ' ASP . 0.0 OUTLIER -46.0 -53.38 10.17 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.241 0.338 . . . . 0.0 110.967 -179.882 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.92 -24.48 66.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.923 0.392 . . . . 0.0 110.863 179.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.0 mtpt -82.61 -29.21 30.3 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.196 0.522 . . . . 0.0 110.652 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.6 mm -73.02 -35.59 48.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.132 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.62 -26.34 15.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.578 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.446 ' O ' ' CG2' ' A' ' 69' ' ' THR . 1.1 m -106.44 22.11 16.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.703 0.287 . . . . 0.0 111.705 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.446 ' CG2' ' O ' ' A' ' 68' ' ' SER . 0.6 OUTLIER 177.74 155.86 0.35 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.836 179.568 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 9.2 mtp -82.59 72.48 9.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.818 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.4 mmm -68.71 134.13 49.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.96 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.59 138.84 33.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.731 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.18 -31.57 53.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.911 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.82 -43.34 98.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.641 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -68.08 -31.5 71.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.685 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.412 HG22 HD12 ' A' ' 76' ' ' ILE . 29.7 mm -71.82 -38.08 64.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.869 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -52.07 56.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.899 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.74 -48.85 79.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.721 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -56.35 -32.6 64.86 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 178.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.415 ' CE2' ' HG2' ' A' ' 23' ' ' LYS . 1.9 t80 -64.65 -35.9 82.53 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 177.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -69.57 -37.66 77.06 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.057 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.05 -36.08 76.52 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 121.186 0.517 . . . . 0.0 109.678 178.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.0 mt -76.2 -30.54 58.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.004 178.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 60.9 t -68.97 -35.84 71.09 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.457 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.01 -49.24 38.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.086 0.469 . . . . 0.0 110.322 179.52 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.1 p -65.01 -41.6 95.19 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.212 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.5 m -64.54 -50.17 68.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.587 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -51.97 -41.99 62.56 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.676 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.96 -30.64 68.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.723 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 tt -64.91 -48.98 72.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.42 HD23 ' CE1' ' A' ' 34' ' ' PHE . 6.9 mt -62.06 -49.57 75.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.068 0.461 . . . . 0.0 109.977 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.4 m -56.49 -30.7 63.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.72 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.456 ' HA ' ' HG2' ' A' ' 96' ' ' LYS . . . -69.88 -53.28 18.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.159 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.8 mt -61.87 -45.61 93.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.044 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -62.11 -44.93 95.58 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.207 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.456 ' HG2' ' HA ' ' A' ' 93' ' ' ALA . 1.3 pttm -61.68 -29.49 70.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.936 0.398 . . . . 0.0 110.184 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.9 mtmm . . . . . 0 C--N 1.332 -0.181 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.109 179.683 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.744 0.307 . . . . 0.0 110.78 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 10.4 mt -55.88 -32.94 64.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.046 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.6 p -63.84 -45.75 96.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.013 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.1 mttt -60.3 -49.27 78.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.094 0.473 . . . . 0.0 110.48 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.403 ' CG1' ' CE ' ' A' ' 63' ' ' MET . 21.6 t -56.96 -43.48 80.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.403 179.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.02 -38.05 95.44 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.645 -0.788 . . . . 0.0 111.452 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.2 m -56.76 -45.63 81.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.084 0.468 . . . . 0.0 109.938 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.4 ' CD2' ' CD1' ' A' ' 83' ' ' LEU . 8.6 tp -61.91 -38.37 88.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.895 179.119 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -41.22 67.94 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 178.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -65.06 -37.93 89.18 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.471 178.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.02 -33.39 75.94 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.929 178.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.1 mt -62.17 -51.91 65.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.166 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -57.91 -36.78 72.93 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.211 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.1 tptt -58.61 -43.97 89.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.469 179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -62.72 -42.56 99.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.424 179.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -54.13 -45.64 71.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.838 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -55.27 32.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.895 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 31.5 t -55.94 -38.69 53.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.914 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.6 t -75.19 -33.81 29.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.75 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.0 t -61.2 -33.29 73.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.512 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.2 -29.95 67.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.779 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.55 79.92 1.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.797 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.45 -27.9 2.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.396 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -56.38 107.39 0.37 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.967 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 80.89 54.59 3.58 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.321 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.491 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -82.61 -45.97 0.92 Allowed Pre-proline 0 C--N 1.329 -0.301 0 N-CA-C 111.44 0.163 . . . . 0.0 111.44 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 52.7 Cg_exo -53.19 -43.75 54.61 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.296 1.998 . . . . 0.0 112.424 -179.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -58.37 -49.53 76.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.941 0.401 . . . . 0.0 110.622 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.409 ' O ' HG13 ' A' ' 52' ' ' ILE . 4.9 t -60.86 -54.93 28.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.74 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.404 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 21.2 m-80 -54.02 -25.73 22.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.032 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.83 -51.74 20.96 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.955 0.407 . . . . 0.0 111.52 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -73.26 -45.41 55.95 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.469 0.652 . . . . 0.0 109.276 179.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.4 mt -57.51 -31.95 40.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.312 178.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 25.6 tttt -69.32 -52.41 27.59 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.475 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.9 m-20 -51.14 -41.68 60.25 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.834 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.8 mp -68.86 -42.98 76.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.256 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.75 -36.6 69.95 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 178.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 11.8 mt -71.31 -42.43 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.329 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.1 m -59.73 -54.97 40.12 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.722 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 45.6 mt -58.5 -53.94 39.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.879 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.9 -34.39 67.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.578 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.58 -49.62 76.8 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.244 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.652 ' O ' HG12 ' A' ' 66' ' ' ILE . 2.1 mp -55.53 -54.73 40.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.463 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.404 ' CA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -44.86 -57.0 4.04 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.19 -179.839 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.06 -24.8 64.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.832 0.348 . . . . 0.0 110.599 179.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.7 mtpt -81.96 -29.76 32.02 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.624 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.652 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -71.88 -33.76 49.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.076 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 21.2 mmmt -93.82 -2.51 53.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.273 -179.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.407 ' C ' ' CG2' ' A' ' 69' ' ' THR . 13.0 m -140.17 19.87 2.43 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.407 ' CG2' ' C ' ' A' ' 68' ' ' SER . 0.4 OUTLIER -161.64 161.72 29.68 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.495 179.281 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -95.23 45.65 1.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.028 0.442 . . . . 0.0 110.58 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.84 130.43 29.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.215 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.6 m -80.08 142.38 34.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.747 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -30.52 59.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.74 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -47.25 86.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.434 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -64.31 -32.82 74.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.434 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 25.4 mm -70.59 -36.81 67.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.742 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -63.32 -52.21 62.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.77 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.8 tptt -62.18 -46.62 88.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.561 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -56.45 -33.31 65.77 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -64.35 -37.5 87.74 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.86 -36.54 75.6 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.977 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.45 -36.07 75.24 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.247 0.546 . . . . 0.0 109.794 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.4 ' CD1' ' CD2' ' A' ' 27' ' ' LEU . 2.7 mt -76.74 -31.18 56.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.032 179.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 47.7 t -69.83 -35.14 63.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.617 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -72.21 -49.46 35.22 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.447 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.4 m -66.03 -40.33 90.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.435 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.404 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 28.4 t -64.89 -50.06 68.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.607 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -52.84 -44.43 66.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.842 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -69.41 -27.68 65.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.82 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.405 ' CD1' HG12 ' A' ' 52' ' ' ILE . 7.3 tt -67.73 -49.22 63.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.067 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.9 mt -62.3 -49.11 76.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.175 0.512 . . . . 0.0 109.863 179.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.3 m -55.42 -37.65 67.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.46 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.4 -40.28 74.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.827 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.6 tp -62.64 -51.8 65.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -55.91 -50.53 70.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.618 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -58.81 -28.98 66.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.128 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.8 tttm . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.611 179.517 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.9 p . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.795 0.331 . . . . 0.0 110.838 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.4 mp -64.38 -32.64 74.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.029 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 32.4 t -62.5 -52.78 55.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.291 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.2 tptt -54.17 -45.22 72.04 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.919 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.403 ' HB ' ' CE ' ' A' ' 63' ' ' MET . 11.5 t -56.73 -49.15 79.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.296 179.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.9 -40.07 98.37 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.554 -0.831 . . . . 0.0 111.559 178.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.757 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.1 OUTLIER -56.71 -42.32 78.97 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.253 0.549 . . . . 0.0 109.716 179.269 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.419 HD11 ' CG ' ' A' ' 80' ' ' TYR . 0.8 OUTLIER -59.91 -39.63 86.09 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.181 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -53.88 -35.02 61.14 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.757 ' HG3' ' HA ' ' A' ' 26' ' ' THR . 2.6 mmtt -60.17 -48.26 82.48 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.366 -0.833 . . . . 0.0 109.14 177.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.94 -33.86 62.66 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.402 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.422 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 1.4 mp -63.47 -49.74 72.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.244 179.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.67 -32.91 70.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.324 179.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 tppt? -61.91 -45.93 91.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.284 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.432 ' CZ ' ' HB2' ' A' ' 87' ' ' SER . 8.5 m-85 -60.09 -50.17 74.77 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.659 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -54.22 -38.6 65.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.918 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -51.71 68.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.014 0.435 . . . . 0.0 110.599 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 30.7 t -62.67 -37.85 80.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.736 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.9 t -63.07 -36.22 74.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.954 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.5 m -75.83 -29.22 58.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.926 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.22 -29.21 38.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.376 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.6 pp -93.4 -35.94 12.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.999 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.3 mptt 58.41 102.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.97 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 174.9 122.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.729 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 58.14 68.09 1.87 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.477 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.468 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -69.5 -47.59 25.87 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 111.553 0.205 . . . . 0.0 111.553 -179.705 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.468 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 35.8 Cg_exo -60.52 -49.38 9.04 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.504 2.136 . . . . 0.0 113.07 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -58.21 -50.03 74.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.845 0.355 . . . . 0.0 111.649 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.623 ' O ' HG13 ' A' ' 52' ' ' ILE . 14.6 p -72.66 -46.55 53.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.343 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.472 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 98.9 m-20 -59.43 -39.0 82.14 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.992 -0.283 . . . . 0.0 111.528 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -71.48 -41.85 68.83 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -179.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -71.78 -46.87 56.94 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.623 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.1 mt -57.33 -30.0 34.43 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.059 178.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -69.07 -51.15 41.72 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.342 179.035 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 16.2 m-20 -51.5 -41.44 60.99 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.601 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 26.3 mt -67.41 -43.83 80.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.219 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -37.56 71.17 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.515 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 9.7 mt -71.26 -40.76 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.134 178.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 39.9 t -57.83 -53.01 63.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.477 179.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.4 mt -60.39 -52.98 55.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.568 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.77 -33.67 68.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.465 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.84 -49.36 78.01 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.271 179.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.672 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.2 mp -55.42 -55.1 35.6 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.703 179.448 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.403 ' CE ' ' HB ' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -44.93 -58.54 3.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.164 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.49 -23.8 63.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.683 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -82.48 -29.79 30.34 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.545 179.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.672 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.9 mm -71.63 -35.78 57.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.236 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.7 mmmt -96.07 1.41 52.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.347 -179.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.402 ' C ' ' CG2' ' A' ' 69' ' ' THR . 19.5 m -141.93 23.33 2.07 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.402 ' CG2' ' C ' ' A' ' 68' ' ' SER . 0.7 OUTLIER -160.39 174.03 14.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.924 0.392 . . . . 0.0 110.756 179.239 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.17 38.2 2.27 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.643 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.0 mmm -55.52 141.3 37.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.059 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.3 m -84.9 145.25 27.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.754 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.4 -31.46 61.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.755 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.11 -37.9 84.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.394 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -68.59 -32.57 72.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.515 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 25.6 mm -72.51 -34.48 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.717 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.02 -50.72 61.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.66 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.9 -46.3 88.47 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.5 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -56.45 -34.22 66.64 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.419 ' CG ' HD11 ' A' ' 27' ' ' LEU . 3.3 t80 -64.15 -37.06 86.11 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 177.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.43 -36.89 77.1 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.938 178.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.59 -36.33 76.06 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.126 0.488 . . . . 0.0 109.687 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.7 mt -76.43 -32.42 58.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.917 178.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 58.9 t -67.95 -34.3 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.428 179.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -48.81 39.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.357 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.14 -38.51 91.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.574 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.432 ' HB2' ' CZ ' ' A' ' 34' ' ' PHE . 25.6 p -66.13 -46.49 77.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.596 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.81 -44.21 73.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.972 0.415 . . . . 0.0 110.559 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -67.93 -30.57 69.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.681 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.402 HD22 ' CG ' ' A' ' 34' ' ' PHE . 7.6 tt -62.77 -47.75 82.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.739 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.8 mt -62.41 -49.19 76.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.124 0.488 . . . . 0.0 109.708 179.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 24.1 m -57.1 -40.34 76.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.473 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.73 -51.71 46.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.712 179.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mp -53.48 -51.6 62.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.794 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -55.67 -40.27 72.06 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.089 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.05 -53.28 60.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.61 179.351 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.4 mttt . . . . . 0 C--N 1.326 -0.44 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.196 -179.802 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.857 0.361 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.1 mt -66.13 -32.89 74.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.014 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.1 p -60.63 -49.42 84.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.358 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -46.4 83.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.852 0.358 . . . . 0.0 110.648 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.4 t -56.84 -40.68 72.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.203 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.14 -41.98 96.72 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.646 -0.787 . . . . 0.0 111.424 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.616 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -57.97 -33.26 68.68 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.133 0.492 . . . . 0.0 109.998 179.2 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.421 HD11 ' CE1' ' A' ' 80' ' ' TYR . 13.6 tp -67.98 -45.49 73.98 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.0 mttm -52.8 -33.67 50.04 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.616 ' HG3' ' HA ' ' A' ' 26' ' ' THR . 15.7 mttt -63.52 -47.27 82.35 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.831 178.321 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.435 ' HG2' ' CZ ' ' A' ' 34' ' ' PHE . 63.1 ttt180 -61.34 -32.28 72.16 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.409 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.2 mp -62.47 -50.6 70.81 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.268 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -58.03 -37.64 74.74 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.12 0.486 . . . . 0.0 109.915 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.7 tptt -57.75 -42.83 84.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.061 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.435 ' CZ ' ' HG2' ' A' ' 30' ' ' ARG . 18.9 m-30 -62.5 -42.46 99.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.254 179.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -53.19 -46.14 68.88 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.649 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -59.98 -54.32 47.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.505 179.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.8 t -56.05 -37.86 50.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.559 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.5 t -74.09 -33.53 35.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.583 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.3 t -61.76 -32.93 73.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.313 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.28 -27.44 56.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.212 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 18.7 mt -59.78 -45.76 91.29 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.929 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 63.61 14.7 8.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.487 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -133.55 134.14 42.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.849 0.357 . . . . 0.0 110.9 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 59.0 69.81 1.17 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.487 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.528 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 2.0 mmpm? -82.93 -42.99 0.88 Allowed Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.1 Cg_exo -53.6 -49.0 18.85 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.301 2.0 . . . . 0.0 112.374 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.422 ' HA ' ' NH1' ' A' ' 50' ' ' ARG . 0.9 OUTLIER -55.6 -46.93 77.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.011 0.434 . . . . 0.0 111.076 179.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.61 ' O ' HG13 ' A' ' 52' ' ' ILE . 11.8 t -65.83 -55.69 18.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.136 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -53.43 -34.9 59.59 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -179.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.445 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 5.3 ptp85 -74.37 -35.23 63.53 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -179.365 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.445 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 26.2 mt-30 -80.71 -47.56 13.81 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.554 0.692 . . . . 0.0 109.531 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 48' ' ' VAL . 2.6 mt -60.23 -33.67 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.101 178.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.404 ' O ' HG13 ' A' ' 57' ' ' ILE . 0.2 OUTLIER -70.03 -54.13 14.53 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.265 179.776 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.413 ' ND2' ' HA ' ' A' ' 51' ' ' GLN . 26.8 p30 -59.01 -25.48 63.69 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.738 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 84.6 mt -79.27 -44.44 21.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.356 . . . . 0.0 110.102 178.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.71 -35.67 68.8 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.407 ' CD1' ' HA ' ' A' ' 54' ' ' ASN . 12.0 mt -70.54 -41.88 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.127 178.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 24.2 m -58.69 -55.14 38.91 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.472 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.0 mt -60.61 -52.51 60.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.63 179.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -58.48 -34.1 70.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.505 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.33 -49.63 76.51 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.024 0.44 . . . . 0.0 110.023 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.666 ' O ' HG12 ' A' ' 66' ' ' ILE . 0.7 OUTLIER -55.61 -52.81 62.52 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.277 178.967 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.4 ' CA ' HG12 ' A' ' 66' ' ' ILE . 17.7 tpp -45.02 -57.92 3.52 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.211 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.9 -24.2 64.1 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.619 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -81.97 -29.78 31.98 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.539 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.666 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.8 mm -71.63 -36.38 59.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.095 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt -96.18 1.23 52.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.945 -0.571 . . . . 0.0 112.265 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.406 ' C ' ' CG2' ' A' ' 69' ' ' THR . 3.0 t -138.46 20.49 2.74 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.406 ' CG2' ' C ' ' A' ' 68' ' ' SER . 0.7 OUTLIER -160.84 177.08 10.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.888 0.375 . . . . 0.0 110.649 179.405 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.3 ttt -109.21 41.39 1.64 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.536 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 15.3 mmm -55.49 145.02 23.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.138 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.48 146.65 23.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.797 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 86.4 mtm-85 -54.75 -31.37 58.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.797 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.8 -39.0 87.26 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.414 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -67.47 -34.3 76.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.433 179.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 26.1 mm -72.09 -34.0 48.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.721 179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -66.68 -46.34 75.95 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.801 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 4.8 mmmt -66.54 -47.54 72.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.694 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.66 -34.18 67.09 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.421 ' CE1' HD11 ' A' ' 27' ' ' LEU . 88.3 t80 -64.96 -36.67 85.13 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.77 -37.79 76.52 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.936 178.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.98 -32.26 71.82 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.111 0.481 . . . . 0.0 109.758 178.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.4 ' CD1' ' CD2' ' A' ' 27' ' ' LEU . 5.0 mt -78.31 -30.62 48.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.021 178.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 60.2 t -68.97 -37.05 76.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.368 179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -49.15 35.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.452 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.7 p -64.47 -45.28 88.05 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.727 179.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 89.4 p -60.21 -49.28 78.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.56 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -54.5 -39.52 67.64 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.764 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -68.12 -31.63 71.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.753 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.8 tt -66.05 -46.46 77.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.997 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.433 HD23 ' CE1' ' A' ' 34' ' ' PHE . 6.5 mt -65.14 -48.52 73.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.169 0.509 . . . . 0.0 109.809 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.3 m -57.07 -32.68 66.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.539 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.416 ' O ' ' CG ' ' A' ' 96' ' ' LYS . . . -70.07 -53.11 18.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.777 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 14.4 mt -58.87 -42.2 88.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.672 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.97 -49.71 75.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.036 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.416 ' CG ' ' O ' ' A' ' 93' ' ' ALA . 27.3 pttt -61.61 -28.65 69.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.939 0.399 . . . . 0.0 110.46 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mttm . . . . . 0 C--N 1.332 -0.19 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.692 -179.783 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.766 0.317 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.6 mt -57.06 -35.97 69.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.072 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.8 p -69.34 -46.69 76.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.191 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -60.15 -46.52 89.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.168 0.509 . . . . 0.0 110.506 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.449 HG11 ' CG2' ' A' ' 59' ' ' ILE . 14.4 t -56.83 -45.97 83.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.632 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.76 -38.77 95.75 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.55 -0.833 . . . . 0.0 111.704 179.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -56.89 -43.85 81.74 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.057 0.456 . . . . 0.0 110.153 179.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.416 HD12 ' CD2' ' A' ' 80' ' ' TYR . 0.7 OUTLIER -61.63 -42.02 98.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.054 179.254 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.88 -40.07 63.19 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 178.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.53 -38.64 91.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.63 178.44 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -63.48 -36.56 84.16 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.922 179.12 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.9 mp -62.03 -43.52 98.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.254 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.28 -47.42 85.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.843 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.442 ' HG3' ' N ' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -60.06 -33.64 72.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.006 -179.991 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.452 ' CE1' ' CD2' ' A' ' 91' ' ' LEU . 10.8 m-85 -65.59 -43.91 88.25 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.512 179.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -60.77 -39.3 88.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.476 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -59.15 -54.69 44.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.478 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 24.0 t -58.8 -37.9 69.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.781 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.0 t -70.74 -31.45 45.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.061 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.3 m -73.82 -27.1 60.94 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.98 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.45 -34.86 65.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.413 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.1 pp -87.79 -25.98 23.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.284 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 4.7 mptt 58.55 179.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.974 0.416 . . . . 0.0 111.114 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.5 t70 70.13 149.12 0.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.749 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.47 24.76 66.2 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.375 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.454 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -54.3 -48.93 93.12 Favored Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 111.516 0.191 . . . . 0.0 111.516 -179.836 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 50.5 Cg_exo -53.79 -46.84 30.73 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.292 1.995 . . . . 0.0 112.581 -179.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -63.12 -50.44 70.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.412 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.463 ' O ' HG13 ' A' ' 52' ' ' ILE . 11.9 t -65.11 -55.78 18.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.148 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.61 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 73.6 m-20 -54.07 -28.42 38.82 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.224 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.4 -49.54 33.07 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.406 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 28.4 mt-30 -74.15 -43.5 57.2 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.532 0.682 . . . . 0.0 109.588 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.2 mt -57.15 -36.2 50.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.376 179.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.61 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -69.08 -46.02 68.84 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.187 178.835 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.7 m-20 -51.19 -41.34 60.15 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.732 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 51' ' ' GLN . 5.3 mt -69.25 -43.3 74.25 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 120.722 0.296 . . . . 0.0 110.351 179.33 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -36.43 69.31 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 10.9 mt -70.96 -42.25 77.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 115.096 -0.957 . . . . 0.0 110.171 178.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.5 m -59.49 -46.12 89.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.419 179.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.449 ' CG2' HG11 ' A' ' 24' ' ' VAL . 46.3 mt -63.97 -53.49 43.37 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.527 179.443 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.429 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 96.0 m-20 -57.26 -34.19 68.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.301 179.437 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.88 -49.1 78.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.783 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.657 ' O ' HG12 ' A' ' 66' ' ' ILE . 0.8 OUTLIER -55.78 -56.49 19.93 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.998 179.929 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.443 ' H ' ' HG2' ' A' ' 63' ' ' MET . 0.0 OUTLIER -45.6 -53.78 8.62 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 123.198 0.311 . . . . 0.0 110.792 -179.92 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.07 -25.19 66.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.927 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 mtmp? -82.35 -30.42 30.38 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.137 0.494 . . . . 0.0 110.596 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -71.22 -33.81 52.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.99 -179.495 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.81 0.95 57.51 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.214 -179.302 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 m -142.88 22.12 1.94 Allowed 'General case' 0 C--O 1.233 0.192 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -160.34 157.4 27.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.605 179.206 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.63 36.49 1.77 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.49 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.7 138.71 55.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.071 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.9 m -74.32 145.71 43.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.806 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.26 -30.61 62.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.668 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -59.37 -45.1 92.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.427 179.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -60.24 -33.58 72.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.376 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 19.1 mm -70.88 -34.07 54.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.497 179.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -50.88 68.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.609 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.8 mmtm -61.14 -46.34 90.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.47 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -56.52 -33.47 66.08 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.416 ' CD2' HD12 ' A' ' 27' ' ' LEU . 2.5 t80 -63.81 -38.08 89.78 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 177.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.6 -36.36 76.14 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.144 178.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.97 -37.36 76.6 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.253 0.549 . . . . 0.0 109.921 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 24.8 mt -76.48 -30.08 57.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.112 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 49.0 t -71.11 -34.66 55.74 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.543 179.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -72.02 -49.28 38.27 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.436 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.5 m -62.95 -40.81 98.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.28 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 m -62.93 -50.07 72.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.513 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -52.38 -41.75 63.39 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.021 0.439 . . . . 0.0 110.747 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -67.5 -32.74 73.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.688 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.1 tt -64.98 -47.08 78.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.964 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.452 ' CD2' ' CE1' ' A' ' 34' ' ' PHE . 6.7 mt -60.88 -48.79 80.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.238 0.542 . . . . 0.0 109.982 179.63 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.04 -42.69 72.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.334 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.91 -36.83 84.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.316 179.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.9 mt -66.91 -42.68 85.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.427 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.95 -54.19 47.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.325 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.77 -28.74 69.66 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.261 179.187 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.3 tttm . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.156 179.992 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.4 m . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.672 0.272 . . . . 0.0 111.034 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -53.67 -32.76 52.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.085 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.0 p -57.74 -48.35 83.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.303 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 22.0 mttt -64.48 -41.92 96.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.888 0.375 . . . . 0.0 110.421 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 25.5 t -57.48 -48.49 82.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.703 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -59.35 -41.22 96.83 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.624 -0.798 . . . . 0.0 111.801 179.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.69 -36.3 74.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.905 0.383 . . . . 0.0 110.263 179.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.416 HD11 ' CE2' ' A' ' 80' ' ' TYR . 0.4 OUTLIER -64.59 -47.01 80.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.752 179.336 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.4 tttm -53.18 -36.37 60.86 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -68.72 -35.11 76.72 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.451 178.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -34.48 77.86 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.893 178.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.2 mp -63.71 -50.36 69.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.128 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -58.02 -35.76 71.73 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.19 179.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.9 tptt -60.4 -46.13 91.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.348 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -59.59 -42.7 93.14 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.49 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -58.28 -40.77 82.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.474 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -59.47 -49.74 76.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.508 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.4 t -63.2 -37.9 80.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.505 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.2 t -68.23 -38.26 79.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.787 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.3 m -67.58 -30.72 70.41 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.738 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.57 -29.74 69.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.276 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.2 pp -100.99 -22.52 14.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.208 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 63.08 -173.82 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.912 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 62.24 155.46 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.758 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 63.7 33.16 86.51 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.319 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.554 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 16.8 mmtp -62.97 -55.29 38.98 Favored Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 10.0 Cg_endo -53.55 -43.03 61.13 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.561 2.174 . . . . 0.0 112.856 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -66.5 -41.02 89.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.786 0.327 . . . . 0.0 111.185 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.516 ' O ' HG13 ' A' ' 52' ' ' ILE . 47.4 t -71.19 -56.24 11.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.45 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 21.1 p30 -59.26 -25.46 64.08 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.946 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 11.1 ttt-85 -72.92 -47.14 48.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.778 0.323 . . . . 0.0 111.386 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -76.64 -46.05 27.46 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.421 0.629 . . . . 0.0 109.598 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.8 mt -57.39 -34.09 45.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.372 179.109 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 4.9 tptt -69.41 -52.36 27.69 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.534 179.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.426 ' HA ' HD12 ' A' ' 57' ' ' ILE . 15.2 m-20 -51.52 -34.16 34.94 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.539 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.9 mt -76.63 -43.26 39.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.392 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.71 -35.0 68.01 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.435 HD12 ' HG3' ' A' ' 53' ' ' LYS . 14.0 mt -70.49 -43.49 77.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.187 178.728 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.7 t -57.91 -45.92 85.77 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.681 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 13.9 mt -59.94 -54.47 34.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.757 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -57.54 -33.52 68.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.622 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.81 -49.55 77.27 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.474 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.664 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.5 mp -55.73 -55.03 37.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.695 179.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 9.3 tpp -45.12 -55.57 5.56 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.267 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.89 -24.24 66.82 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.805 0.336 . . . . 0.0 110.546 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.408 ' O ' ' OG1' ' A' ' 69' ' ' THR . 4.6 mtmm -82.25 -28.91 31.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.473 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.664 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.1 mm -71.88 -40.65 68.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.336 -179.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -92.56 -29.05 16.38 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.773 -179.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.417 ' O ' ' CG2' ' A' ' 69' ' ' THR . 1.2 t -103.14 24.41 10.89 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.714 0.264 . . . . 0.0 111.714 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.417 ' CG2' ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 177.53 150.14 0.18 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.156 179.623 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 11.0 ttp -75.17 64.37 1.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.872 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.63 124.49 21.12 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.779 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.8 m -77.11 136.38 38.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.771 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.3 mtm180 -52.77 -35.29 56.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.911 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -59.94 -42.34 93.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.458 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -67.22 -32.59 73.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.515 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 27.1 mm -70.11 -37.13 71.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.828 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -65.1 -50.36 66.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.692 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -63.57 -46.9 83.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.675 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -56.46 -34.0 66.45 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.416 ' CE2' HD11 ' A' ' 27' ' ' LEU . 3.5 t80 -64.15 -37.36 87.16 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -69.72 -36.8 76.2 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.17 178.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.74 -39.89 78.41 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.249 0.547 . . . . 0.0 109.681 179.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mt -74.34 -30.19 61.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.062 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 57.3 t -70.2 -36.2 66.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.413 179.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.71 -49.43 58.97 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.204 179.467 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 58.5 m -63.95 -43.6 95.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.982 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.42 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 67.3 m -60.98 -50.0 75.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.338 179.329 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -50.3 -43.66 53.76 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.637 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -37.28 86.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.464 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.98 -44.14 96.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.929 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.5 mt -62.63 -48.67 78.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.08 0.466 . . . . 0.0 109.918 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.2 t -57.2 -43.58 82.85 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.645 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.07 -46.17 82.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.797 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.4 tp -61.67 -44.97 95.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.827 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.83 -44.86 78.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.775 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -58.4 -48.92 79.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.524 179.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.217 -179.958 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.806 0.336 . . . . 0.0 110.971 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 17.7 mt -53.85 -32.86 54.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.109 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.9 p -63.99 -46.78 93.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.1 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.71 -46.76 77.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.06 0.457 . . . . 0.0 110.614 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.3 t -57.0 -44.39 82.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.357 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.4 -38.24 95.41 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.646 -0.788 . . . . 0.0 111.574 179.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.7 -42.92 84.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.973 0.416 . . . . 0.0 110.102 179.232 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.404 ' CD1' ' CD1' ' A' ' 31' ' ' LEU . 1.5 tm? -61.59 -43.73 98.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.105 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.86 -39.54 62.65 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 178.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.83 -36.83 85.59 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.579 178.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.06 -33.1 75.23 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.901 178.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.422 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 2.2 mp -62.74 -52.54 62.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.284 179.331 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.77 -36.1 71.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.329 179.463 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -59.63 -44.67 93.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.411 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.422 ' CD2' ' HA ' ' A' ' 31' ' ' LEU . 11.5 m-85 -60.93 -43.22 98.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.509 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -54.24 -46.7 72.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.793 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -58.73 -51.39 70.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.891 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.7 t -61.32 -40.24 85.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.992 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 56.2 t -68.0 -39.76 82.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.93 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.5 t -69.12 -25.19 64.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.929 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.21 -32.21 64.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.391 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.7 pp -96.39 -21.64 17.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.34 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.62 -174.97 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.039 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.4 t70 70.82 139.14 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.855 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 60.71 60.35 8.62 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.269 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.485 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 13.9 mmtp -83.68 -46.01 0.79 Allowed Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 111.398 0.147 . . . . 0.0 111.398 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.485 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.9 Cg_exo -53.29 -41.32 73.46 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.322 2.015 . . . . 0.0 112.446 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -67.8 -39.51 83.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.922 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.571 ' O ' HG13 ' A' ' 52' ' ' ILE . 33.6 t -70.82 -56.36 11.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.324 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.419 ' O ' ' CG ' ' A' ' 53' ' ' LYS . 15.4 p30 -60.28 -25.33 65.65 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.018 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.418 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 7.4 tpp180 -73.55 -43.57 59.58 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.761 0.315 . . . . 0.0 111.405 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.42 ' HA ' ' ND2' ' A' ' 54' ' ' ASN . 3.2 mt-30 -81.31 -44.71 17.26 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.367 0.603 . . . . 0.0 110.0 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 48' ' ' VAL . 2.3 mt -58.09 -40.99 79.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.63 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.419 ' CG ' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -70.5 -50.8 34.04 Favored 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.42 ' ND2' ' HA ' ' A' ' 51' ' ' GLN . 30.2 p30 -59.68 -25.42 64.73 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.086 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 50.7 mt -80.02 -43.95 21.01 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.097 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -34.75 67.87 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 53' ' ' LYS . 13.3 mt -71.1 -43.5 75.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.1 178.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.53 -47.35 84.46 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.334 179.422 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.9 mt -58.44 -53.04 52.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.717 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -59.4 -33.85 71.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.624 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.62 -50.43 73.18 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.978 0.418 . . . . 0.0 110.316 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.661 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.0 OUTLIER -56.32 -54.93 39.6 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.306 179.071 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.89 -57.48 3.75 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.191 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.45 -24.87 63.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.957 0.408 . . . . 0.0 110.701 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 24.0 mtpt -82.27 -29.59 31.14 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.577 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.661 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -72.79 -35.33 49.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.202 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.01 1.26 57.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.16 -179.101 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.4 m -136.22 21.09 3.2 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.945 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.4 p -160.05 -168.35 2.19 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.949 0.404 . . . . 0.0 110.626 179.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 5.0 tpt -130.92 37.21 3.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.459 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 33.3 mtp -56.61 139.63 49.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.01 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.8 m -74.53 144.08 44.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.715 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.9 mtt180 -55.04 -30.41 59.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.584 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.88 -44.16 86.5 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.249 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -36.29 79.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.021 179.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.469 HD11 HG21 ' A' ' 76' ' ' ILE . 23.0 mm -71.19 -34.06 53.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.368 179.31 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -52.01 67.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.443 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 mppp? -61.91 -46.4 89.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.33 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -56.43 -33.78 66.17 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 12.0 t80 -63.54 -37.47 87.44 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -69.59 -36.2 76.03 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.801 178.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.56 -35.6 74.56 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-O 121.136 0.493 . . . . 0.0 109.728 178.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mt -77.13 -31.58 55.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.062 178.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 41.4 t -71.34 -35.03 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.571 179.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.99 -47.32 52.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.598 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.5 m -69.88 -36.86 75.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.709 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.1 m -65.08 -50.46 66.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.697 179.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -39.35 82.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.647 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -65.83 -31.17 71.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.561 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.2 tt -66.67 -48.19 70.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.697 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 5.8 mt -64.99 -46.64 80.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.168 0.508 . . . . 0.0 109.89 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.87 -35.43 70.95 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.636 179.553 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.43 -37.61 77.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.669 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.7 mt -71.42 -43.34 66.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.624 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -54.11 48.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.773 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.3 -34.92 77.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.138 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.525 179.377 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.3 p . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.817 0.342 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 10.9 mt -58.94 -32.77 69.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.006 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.7 t -61.71 -52.28 62.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.041 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -53.0 -41.24 64.46 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.999 0.428 . . . . 0.0 110.745 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.406 ' CG1' ' CG2' ' A' ' 59' ' ' ILE . 51.4 t -60.78 -49.73 83.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.332 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.19 -37.54 93.09 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.703 -0.76 . . . . 0.0 111.837 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.01 -46.86 82.02 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.912 0.387 . . . . 0.0 110.26 179.487 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 22.8 tp -62.01 -37.26 84.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.277 -0.419 . . . . 0.0 109.9 179.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.68 -38.89 70.23 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -38.65 88.29 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.672 178.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 20.1 mmt180 -59.8 -38.59 82.35 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.136 -0.483 . . . . 0.0 109.975 179.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.9 mt -62.5 -48.7 78.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.048 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.02 -38.06 75.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.087 179.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.2 tptt -58.9 -42.23 89.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.018 179.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -61.13 -43.95 98.09 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.25 179.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -54.56 -43.31 71.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.555 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.79 -52.61 64.99 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.393 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 24.0 t -59.31 -37.81 71.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.582 179.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 41.0 t -70.07 -31.2 46.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.895 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.42 -27.64 61.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.593 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.35 -34.4 76.03 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.205 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.8 pp -92.07 -20.19 21.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.245 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.19 -173.55 0.1 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.866 0.365 . . . . 0.0 110.898 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 64.57 151.56 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.805 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 59.8 29.17 66.9 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.306 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.525 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 0.4 OUTLIER -56.2 -57.55 21.91 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 120.494 0.188 . . . . 0.0 111.252 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 11.3 Cg_endo -54.96 -33.88 84.39 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.436 2.09 . . . . 0.0 112.228 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -67.07 -49.06 66.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.705 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.511 ' O ' HG13 ' A' ' 52' ' ' ILE . 25.8 t -69.93 -55.17 15.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.95 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.582 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 65.3 m-20 -52.85 -32.87 46.92 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.684 0.278 . . . . 0.0 111.106 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.6 ttt85 -72.15 -46.21 57.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.869 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.403 ' HG2' ' HA ' ' A' ' 48' ' ' VAL . 9.3 pt20 -73.04 -45.59 56.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.657 0.741 . . . . 0.0 109.472 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.511 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.7 mt -57.56 -32.89 43.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.314 178.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.582 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 7.1 tmtm? -69.16 -49.8 53.49 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.343 178.834 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.406 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 16.9 m-20 -50.98 -39.84 56.43 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.578 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.427 ' CD2' ' N ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -71.17 -43.01 68.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.182 179.345 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -57.01 -36.79 70.84 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 178.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 53' ' ' LYS . 12.2 mt -69.63 -42.1 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.173 178.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.7 t -57.62 -51.52 69.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.192 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.406 ' CG2' ' CG1' ' A' ' 24' ' ' VAL . 5.9 mt -57.92 -46.49 87.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.281 179.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.8 -35.24 75.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.351 179.446 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.92 -49.81 75.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.283 179.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.658 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.6 mp -55.53 -54.0 49.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.439 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.15 -54.3 7.02 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.291 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.95 -25.22 67.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.863 0.363 . . . . 0.0 110.685 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 25.0 mtpt -82.04 -28.66 32.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.565 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.7 mm -73.06 -38.06 54.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.43 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.15 -27.57 16.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.715 -179.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.447 ' O ' ' CG2' ' A' ' 69' ' ' THR . 1.4 m -105.88 25.33 11.03 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.447 ' CG2' ' O ' ' A' ' 68' ' ' SER . 0.3 OUTLIER 174.14 155.12 0.12 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.878 179.678 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.6 mmt -83.23 82.44 8.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.946 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -84.18 119.03 24.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.054 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.7 m -73.43 144.34 46.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.607 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -52.65 -34.07 49.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.948 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -58.25 -49.09 78.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.47 179.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.32 -34.35 72.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.179 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.482 HD13 HG23 ' A' ' 76' ' ' ILE . 21.9 mm -72.4 -34.19 47.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.574 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -60.54 -48.58 81.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.519 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.71 -45.74 85.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.35 179.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.91 -35.99 69.65 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 178.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.463 ' CE2' ' CG2' ' A' ' 76' ' ' ILE . 9.5 m-85 -63.59 -35.08 79.31 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -68.92 -36.76 78.36 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.831 178.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.09 -35.16 76.25 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.261 0.553 . . . . 0.0 109.573 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.9 mt -76.56 -31.96 57.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.035 178.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 49.3 t -69.15 -34.16 62.02 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.362 179.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.9 mmpt? -72.03 -49.12 39.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.426 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 m -68.27 -37.52 80.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.609 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 98.7 p -67.06 -49.08 66.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.663 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -55.88 -43.96 77.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.975 0.417 . . . . 0.0 110.779 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -67.29 -30.67 70.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.729 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.1 tt -63.17 -47.63 81.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.018 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.4 mt -63.54 -47.2 82.57 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.215 0.531 . . . . 0.0 109.84 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 49.4 m -58.31 -42.93 87.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.505 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.77 -33.49 75.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.566 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.9 tp -67.59 -49.18 64.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.669 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -55.75 -47.0 77.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.597 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.1 pttp -65.34 -28.74 69.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.03 0.443 . . . . 0.0 109.825 178.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt . . . . . 0 C--O 1.231 0.12 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.177 179.786 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.9 p . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.74 0.305 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.5 mt -55.11 -32.5 62.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.165 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.5 p -51.78 -46.99 40.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.36 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.69 -43.83 95.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.14 0.495 . . . . 0.0 110.371 179.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.1 t -57.61 -44.47 85.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.492 179.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.16 -38.57 96.38 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.716 179.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.82 -46.06 81.88 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.079 0.466 . . . . 0.0 110.096 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.425 HD11 ' CZ ' ' A' ' 80' ' ' TYR . 9.5 tp -62.12 -37.19 84.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.883 178.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.56 -38.77 69.76 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.671 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -38.01 84.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.706 178.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -61.22 -37.17 82.07 Favored 'General case' 0 N--CA 1.458 -0.068 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.178 179.336 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.413 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 2.6 mm? -63.91 -52.19 61.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.174 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.04 -32.43 67.97 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.303 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.6 tptt -63.07 -45.13 93.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.326 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.413 ' CD2' ' HA ' ' A' ' 31' ' ' LEU . 13.3 m-85 -60.4 -43.4 96.7 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.59 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -57.33 -42.64 82.31 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.726 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.01 -52.45 65.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.715 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.7 t -60.95 -37.95 78.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.871 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 56.1 t -70.09 -32.77 52.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.037 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -72.68 -29.32 63.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.861 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.05 -28.73 64.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.21 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 pp -101.49 -24.25 14.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.202 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.49 -169.7 0.15 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.816 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 64.51 136.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.76 -179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.2 26.16 72.84 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.327 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.556 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 1.9 mmtt -56.53 -55.72 39.73 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.52 0.2 . . . . 0.0 111.354 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.556 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 9.8 Cg_endo -53.49 -44.15 51.48 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.348 2.032 . . . . 0.0 112.275 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.88 -49.45 77.41 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.034 0.445 . . . . 0.0 110.511 179.664 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.446 ' O ' HG13 ' A' ' 52' ' ' ILE . 17.8 t -60.9 -55.28 25.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.756 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.401 ' O ' ' CB ' ' A' ' 53' ' ' LYS . 42.5 m-20 -54.83 -25.61 29.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.115 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -50.41 28.63 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.843 0.354 . . . . 0.0 111.555 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -74.89 -45.17 44.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.496 0.665 . . . . 0.0 109.398 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.5 mt -57.81 -32.35 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.276 178.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.401 ' CB ' ' O ' ' A' ' 49' ' ' ASN . 26.9 tttt -69.35 -52.75 24.19 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.429 179.242 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.41 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 22.1 m-20 -50.95 -39.3 54.64 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.743 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.402 ' N ' ' CD2' ' A' ' 55' ' ' LEU . 0.3 OUTLIER -70.65 -43.68 68.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.283 179.592 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.72 -35.87 69.04 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.53 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.41 ' CD1' ' HA ' ' A' ' 54' ' ' ASN . 11.9 mt -71.12 -42.56 75.9 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.31 178.723 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.1 m -58.89 -49.68 76.88 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.406 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.0 mt -60.79 -53.49 48.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.552 179.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.84 -34.69 71.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.503 179.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.67 -49.7 75.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.269 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.655 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.0 OUTLIER -55.76 -54.67 41.53 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.405 179.186 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.0 -58.08 3.41 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.218 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.17 -24.53 63.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.881 0.372 . . . . 0.0 110.552 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.14 -29.44 31.62 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.633 179.496 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.655 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -73.0 -34.84 47.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.278 -179.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -87.61 -28.28 22.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.973 -179.163 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.409 ' C ' ' CG2' ' A' ' 69' ' ' THR . 48.0 t -101.31 17.63 22.1 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.409 ' CG2' ' C ' ' A' ' 68' ' ' SER . 0.8 OUTLIER -161.46 -168.02 1.89 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.612 179.376 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.83 39.06 3.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.232 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -51.66 152.7 2.68 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.328 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.7 m -86.12 147.41 26.17 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.803 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -30.93 65.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.585 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -46.28 88.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.282 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -60.42 -33.77 73.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.368 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 23.0 mm -71.07 -35.13 57.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.46 179.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -62.39 -45.46 93.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.562 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.8 tptp -67.01 -49.03 66.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.449 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -56.73 -34.1 67.18 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.425 ' CZ ' HD11 ' A' ' 27' ' ' LEU . 15.4 t80 -64.8 -35.64 81.73 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.42 -0.955 . . . . 0.0 108.42 177.669 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.52 -36.92 76.86 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.896 178.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.23 -36.87 78.71 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 178.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mt -75.75 -31.75 59.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.944 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 87.9 t -67.13 -34.17 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.23 179.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 16.2 tptt -72.13 -49.36 36.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.095 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 t -61.78 -40.84 96.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.323 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.7 p -64.41 -48.95 73.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.438 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.91 -44.04 49.93 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.595 179.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.18 -29.72 66.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.564 179.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 9.1 tt -65.43 -48.96 70.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.807 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.6 mt -62.33 -45.63 92.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.203 0.525 . . . . 0.0 109.665 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 60.3 p -54.79 -42.94 72.4 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.382 179.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.06 -45.23 94.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.43 179.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.93 -49.11 72.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.239 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -56.4 -38.69 71.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.414 179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.62 -32.27 73.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.029 179.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.1 mttt . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.249 179.972 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.819 0.343 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -143.85 166.42 27.01 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.529 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -52.58 -61.82 0.44 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.551 2.167 . . . . 0.0 112.342 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.94 -90.78 0.88 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.511 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 m -85.21 -24.85 27.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.712 0.291 . . . . 0.0 111.001 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.3 mt -55.18 -32.81 62.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.004 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.3 p -53.33 -46.0 57.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.309 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.66 -46.31 89.43 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.027 0.441 . . . . 0.0 110.537 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.411 ' CG1' ' CE ' ' A' ' 63' ' ' MET . 20.6 t -56.92 -43.82 81.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.665 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -63.71 -37.53 94.86 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.644 -0.789 . . . . 0.0 111.891 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.06 -47.94 79.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.895 0.379 . . . . 0.0 110.224 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.418 HD12 ' CE2' ' A' ' 80' ' ' TYR . 0.8 OUTLIER -61.22 -41.02 96.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.072 179.387 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.06 -38.58 62.6 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 mptt -65.85 -40.54 91.8 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.496 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.4 mmt85 -63.06 -33.3 75.15 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.775 178.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.426 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.4 OUTLIER -62.58 -49.25 75.98 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.218 179.281 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.91 -37.58 74.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.162 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 tptm -59.02 -43.5 91.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.288 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.426 ' CD2' ' HA ' ' A' ' 31' ' ' LEU . 14.1 m-85 -62.47 -40.53 96.96 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.324 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.06 -45.41 79.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.668 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -59.67 -55.27 36.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.575 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 24.1 t -56.08 -38.0 51.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.933 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 49.2 t -75.25 -33.19 27.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.87 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.03 -32.52 73.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.43 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -83.08 -1.79 53.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.537 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.2 mt -89.54 -56.18 3.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.793 0.33 . . . . 0.0 111.006 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.04 3.66 4.45 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.652 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -116.69 138.34 51.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.771 0.32 . . . . 0.0 110.761 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 58.18 52.05 54.83 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.275 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.506 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 5.8 mmtm -72.05 -43.19 10.32 Favored Pre-proline 0 C--N 1.329 -0.289 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.506 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.5 Cg_exo -53.42 -48.92 19.33 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.226 1.95 . . . . 0.0 112.771 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -65.46 -38.68 90.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.531 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.613 ' O ' HG13 ' A' ' 52' ' ' ILE . 25.8 t -72.4 -56.95 8.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.621 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.575 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 28.5 p30 -58.95 -26.17 64.18 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.067 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 54.7 ttm-85 -73.69 -46.37 46.69 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.97 0.414 . . . . 0.0 111.504 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -74.96 -47.44 29.43 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.525 0.679 . . . . 0.0 109.203 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.613 HG13 ' O ' ' A' ' 48' ' ' VAL . 3.7 mt -57.91 -30.92 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.759 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.25 178.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.575 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -70.23 -55.16 9.97 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.594 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.4 ' HA ' HD11 ' A' ' 57' ' ' ILE . 28.2 p30 -59.73 -25.7 65.03 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 120.871 -0.331 . . . . 0.0 111.181 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 45.5 mt -77.44 -46.51 22.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.746 0.308 . . . . 0.0 110.226 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.69 -37.72 71.27 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.4 HD11 ' HA ' ' A' ' 54' ' ' ASN . 9.7 mt -71.4 -39.93 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.109 178.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.1 t -57.76 -55.12 38.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.506 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.414 ' CD1' ' CD1' ' A' ' 31' ' ' LEU . 2.7 mp -58.87 -47.8 88.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.424 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -60.31 -33.95 73.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.352 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.58 -49.5 77.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.327 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.66 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.5 mp -55.5 -52.9 62.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.467 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.411 ' CE ' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.25 -54.07 7.51 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.111 179.769 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.45 -24.83 67.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.598 179.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.405 ' O ' ' OG1' ' A' ' 69' ' ' THR . 1.4 mtpt -81.9 -29.11 32.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.336 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.66 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.9 mm -71.98 -37.63 61.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.031 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.86 -27.96 16.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.571 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.434 ' O ' ' CG2' ' A' ' 69' ' ' THR . 1.6 t -104.12 24.54 11.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.704 0.288 . . . . 0.0 111.58 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.434 ' CG2' ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 175.89 150.05 0.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.823 179.512 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.7 mtt -83.94 72.91 10.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.916 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 8.3 mmm -74.62 138.81 43.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.688 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.2 m -78.06 139.37 39.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.855 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -55.48 -35.02 65.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.665 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -58.27 -44.47 88.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.351 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -61.67 -32.86 73.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.285 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.463 HD13 HG22 ' A' ' 76' ' ' ILE . 22.8 mm -73.1 -36.65 51.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.742 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 37.5 tp60 -60.22 -52.28 65.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.667 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.53 -46.3 86.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.432 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -56.7 -34.21 67.21 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.418 ' CE2' HD12 ' A' ' 27' ' ' LEU . 36.5 t80 -64.5 -36.28 83.67 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.44 -37.07 77.22 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.89 178.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.58 -36.07 75.52 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.257 0.551 . . . . 0.0 109.642 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 20.9 mt -76.1 -31.66 58.8 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.066 178.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 51.1 t -69.41 -34.43 62.26 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.518 179.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 18.2 mmtt -71.98 -49.18 39.47 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.357 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.68 -42.28 82.37 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.463 179.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.401 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 72.6 m -65.08 -47.2 78.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.475 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -54.3 -44.67 72.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.623 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.64 -35.03 79.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.61 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.3 tt -60.24 -45.91 91.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.849 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.418 HD23 ' CE1' ' A' ' 34' ' ' PHE . 7.1 mt -61.58 -51.95 66.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.069 0.462 . . . . 0.0 109.809 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.1 m -56.11 -41.28 75.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.353 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.21 -40.51 90.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.547 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.4 mp -63.85 -44.14 94.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.417 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.412 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 5.4 mp0 -55.85 -50.63 70.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.679 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 16.3 pttp -62.39 -28.65 69.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.101 0.477 . . . . 0.0 109.782 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.33 -55.77 9.47 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.417 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 0.0 OUTLIER -61.88 -47.6 84.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.185 -179.352 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.49 -31.38 72.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.821 0.344 . . . . 0.0 110.925 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -68.14 -39.87 82.57 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.728 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 58.9 28.69 17.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.991 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -160.9 130.57 4.92 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.873 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.259 179.99 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.912 0.387 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -74.85 146.42 35.19 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.507 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -54.21 129.33 33.95 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.47 2.113 . . . . 0.0 112.345 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -123.83 -90.44 0.92 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.473 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.16 -19.21 58.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.647 0.26 . . . . 0.0 111.104 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.2 mp -53.89 -32.71 54.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.129 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.8 p -55.35 -49.68 71.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.268 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.3 mttt -68.92 -43.91 74.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.897 0.379 . . . . 0.0 110.48 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.0 t -57.12 -40.18 71.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.286 179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.53 -39.73 94.04 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.679 -0.772 . . . . 0.0 111.614 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -32.52 72.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.896 0.379 . . . . 0.0 110.087 179.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.426 HD13 ' CD2' ' A' ' 80' ' ' TYR . 0.3 OUTLIER -68.1 -49.9 58.25 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.772 179.137 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -52.99 -33.39 51.27 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.96 -39.3 79.56 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.416 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.427 ' HG3' ' CZ ' ' A' ' 34' ' ' PHE . 2.0 tpt180 -64.12 -31.97 73.36 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.96 -46.25 78.79 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.066 179.097 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -58.06 -37.37 74.3 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.859 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -59.75 -49.78 76.4 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.949 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.427 ' CZ ' ' HG3' ' A' ' 30' ' ' ARG . 11.3 m-85 -60.82 -37.87 83.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.38 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 27.3 m-80 -58.4 -43.54 88.61 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.411 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -51.15 71.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.147 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 36.8 t -57.46 -37.71 59.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.333 179.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 95.5 t -68.57 -41.84 83.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.639 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.8 t -58.17 -34.35 70.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.672 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -86.5 -16.15 37.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.326 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 12.4 mt -74.53 -50.67 17.21 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.167 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 0.1 OUTLIER 67.19 10.47 7.74 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.716 -179.706 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -131.4 152.92 50.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.729 0.299 . . . . 0.0 110.908 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 56.47 33.11 61.68 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.359 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.521 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 17.8 mmtt -53.54 -57.1 18.58 Favored Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 111.53 0.196 . . . . 0.0 111.53 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.521 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 14.2 Cg_endo -57.41 -41.76 68.94 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.391 2.061 . . . . 0.0 113.004 -179.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -64.96 -50.77 65.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.841 0.353 . . . . 0.0 111.509 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.527 ' O ' HG13 ' A' ' 52' ' ' ILE . 8.4 p -69.2 -49.74 58.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.703 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.438 ' OD1' ' N ' ' A' ' 50' ' ' ARG . 44.8 p30 -61.83 -25.14 67.33 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.105 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.438 ' N ' ' OD1' ' A' ' 49' ' ' ASN . 1.0 OUTLIER -73.47 -47.76 38.85 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.808 0.337 . . . . 0.0 111.097 179.875 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -74.76 -46.62 35.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.509 0.671 . . . . 0.0 109.382 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.4 mt -57.27 -32.57 41.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 CA-C-N 114.801 -1.09 . . . . 0.0 110.299 178.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.402 ' O ' HG13 ' A' ' 57' ' ' ILE . 9.0 tttt -69.29 -53.26 20.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.348 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.404 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 9.4 m-20 -53.78 -29.22 39.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.83 0.348 . . . . 0.0 110.861 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.1 mt -77.16 -47.92 19.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.243 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.47 ' HG3' ' N ' ' A' ' 57' ' ' ILE . 0.0 OUTLIER -56.39 -31.3 63.71 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 178.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.47 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 14.8 mt -71.6 -43.57 71.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.107 178.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -58.35 -53.14 61.69 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.772 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 23.0 mt -57.04 -52.43 56.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.791 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.4 -33.79 68.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.306 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.63 -49.35 77.82 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.107 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.658 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.9 mp -55.34 -53.22 58.96 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.446 179.127 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.4 -53.05 9.19 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.042 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.4 ' O ' ' CB ' ' A' ' 68' ' ' SER . . . -63.27 -25.09 68.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.653 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 26.4 mtpt -82.03 -28.87 32.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.132 0.491 . . . . 0.0 110.641 179.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.0 mm -71.49 -41.84 72.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.394 -179.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.66 -29.12 16.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.799 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.43 ' O ' ' CG2' ' A' ' 69' ' ' THR . 0.3 OUTLIER -101.41 21.8 13.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.527 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.43 ' CG2' ' O ' ' A' ' 68' ' ' SER . 0.5 OUTLIER 178.05 155.88 0.38 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.93 179.502 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.97 81.65 4.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.801 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.4 mmm -86.68 141.44 28.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.948 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.8 m -77.96 139.89 39.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.924 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -53.99 -31.99 52.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.95 0.405 . . . . 0.0 110.878 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -59.3 -49.09 79.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.535 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -61.87 -32.3 72.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.44 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 20.5 mm -71.75 -33.94 50.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.74 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -46.6 76.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.926 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 21.8 mmtt -63.4 -51.25 66.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.75 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -56.3 -33.71 65.82 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.426 ' CD2' HD13 ' A' ' 27' ' ' LEU . 2.9 t80 -64.44 -36.19 83.37 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.36 -36.65 77.06 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.959 178.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.91 -39.13 80.58 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 121.285 0.565 . . . . 0.0 109.644 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.1 mt -75.13 -29.49 60.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.095 178.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 64.0 t -71.04 -37.4 67.35 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.269 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -49.31 64.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.181 179.397 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.03 -35.52 80.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.145 179.287 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.425 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 7.3 t -65.69 -46.84 77.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.439 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -56.13 -47.24 78.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.117 0.484 . . . . 0.0 110.649 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.44 -31.37 72.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.735 179.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.4 ' HB3' ' O ' ' A' ' 87' ' ' SER . 4.6 tt -63.99 -42.2 97.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.954 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.4 mt -64.6 -50.34 67.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.201 0.524 . . . . 0.0 110.016 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.6 m -59.08 -39.18 81.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.838 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.4 -53.27 17.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.098 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.1 mp -58.33 -33.59 69.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.024 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -66.98 -51.78 50.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.851 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.424 ' HA ' ' CG ' ' A' ' 99' ' ' GLN . 10.0 pttp -57.53 -28.46 63.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.188 0.518 . . . . 0.0 110.078 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.8 mttp -67.95 -58.59 4.29 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.946 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 0.0 OUTLIER -61.28 -42.19 98.22 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.933 -178.779 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.424 ' CG ' ' HA ' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -65.03 -35.55 81.54 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.126 -0.23 . . . . 0.0 111.344 -179.524 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -75.23 -53.54 8.62 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.736 0.303 . . . . 0.0 110.813 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 46.82 -170.13 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.196 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -85.11 -52.83 5.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.651 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.914 179.855 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.851 0.357 . . . . 0.0 111.066 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.407 ' N ' ' HD3' ' A' ' 18' ' ' PRO . . . 57.79 61.9 6.93 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.771 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.407 ' HD3' ' N ' ' A' ' 17' ' ' GLY . 39.4 Cg_exo -60.22 -50.19 7.79 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.634 2.223 . . . . 0.0 112.075 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.93 89.1 1.46 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.477 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 86.2 p -177.94 -38.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.807 0.337 . . . . 0.0 110.843 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.9 mt -54.83 -32.89 61.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.945 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.3 p -59.11 -45.65 92.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.228 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt -57.98 -44.59 87.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.059 0.457 . . . . 0.0 110.661 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.4 ' CG1' ' HE1' ' A' ' 63' ' ' MET . 14.9 t -56.81 -44.93 82.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.612 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.73 -37.45 94.29 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.721 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.1 m -57.01 -47.27 81.24 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.993 0.425 . . . . 0.0 110.35 179.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.454 ' CD1' ' CZ ' ' A' ' 80' ' ' TYR . 5.1 tp -60.74 -41.4 95.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.166 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -54.37 -36.82 64.29 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.96 -38.71 86.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.681 178.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 mpt_? -63.18 -34.87 78.58 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.89 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.421 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 13.2 mt -63.17 -49.71 73.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.197 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.99 -36.86 73.24 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.11 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.0 tptm -59.32 -44.36 92.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.236 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.428 ' CD1' HD21 ' A' ' 91' ' ' LEU . 7.6 m-85 -62.57 -37.59 86.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.165 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -58.71 -41.6 86.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.439 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.86 -55.15 32.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.495 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.6 t -55.83 -37.87 49.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.573 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.403 ' CG2' HG12 ' A' ' 48' ' ' VAL . 61.1 t -74.22 -35.07 39.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.519 179.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -35.3 71.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.196 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.2 -31.0 68.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.838 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 pp -117.31 80.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.743 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.74 -27.64 5.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.245 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -58.64 98.9 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.877 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 95.66 40.45 4.14 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.5 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.451 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -71.58 -49.98 10.81 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.605 0.24 . . . . 0.0 111.181 -179.952 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.451 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.1 Cg_exo -53.28 -40.36 77.98 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.427 2.085 . . . . 0.0 112.657 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -59.93 -50.56 73.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.02 0.438 . . . . 0.0 110.817 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.466 ' O ' HG13 ' A' ' 52' ' ' ILE . 4.0 t -66.2 -55.32 19.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.749 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.581 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 83.9 m-20 -52.92 -27.86 20.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.049 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 48.8 ttt-85 -71.75 -53.4 13.55 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.916 0.388 . . . . 0.0 111.899 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -69.74 -43.84 71.47 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.786 0.803 . . . . 0.0 109.082 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.4 mt -59.52 -29.99 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.869 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.212 178.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.581 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -69.94 -55.11 10.51 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.403 179.717 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.4 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 27.5 p30 -60.19 -25.7 65.78 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.917 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.4 mt -79.84 -39.07 31.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.731 0.3 . . . . 0.0 110.198 179.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.73 -36.39 82.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 178.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.4 ' CD1' ' HA ' ' A' ' 54' ' ' ASN . 10.2 mt -69.93 -39.23 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.94 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.37 -45.87 83.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.128 179.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 64.0 mt -61.52 -51.1 76.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.127 179.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -58.98 -33.59 70.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.094 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.53 -49.42 76.39 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.885 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.662 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.1 mp -55.23 -51.58 66.14 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.108 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.409 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.35 -54.79 6.75 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.97 179.819 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.47 -25.18 67.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.641 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -82.13 -29.49 31.63 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 121.105 0.478 . . . . 0.0 110.483 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.662 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.8 mm -70.84 -36.53 64.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.939 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.2 mmmm -94.85 1.23 55.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.93 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.1 m -134.12 21.25 3.76 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.4 p -160.22 -167.6 1.97 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.565 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.5 mtm -125.37 33.13 5.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.492 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.1 mtp -58.04 123.69 16.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.091 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.0 m -67.58 145.57 54.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.742 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -55.15 -30.82 60.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.652 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -59.0 -45.55 90.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.314 179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -33.95 72.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.094 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 18.3 mm -72.96 -33.95 44.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.425 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.22 -46.2 91.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.564 179.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -66.37 -48.54 69.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.467 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -56.57 -33.99 66.7 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.454 ' CZ ' ' CD1' ' A' ' 27' ' ' LEU . 9.3 t80 -64.35 -36.52 84.39 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.71 -37.45 76.56 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.963 178.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.29 -34.07 73.24 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 121.203 0.525 . . . . 0.0 109.803 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mt -76.78 -31.44 57.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.04 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 56.7 t -68.59 -36.83 76.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.537 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.02 -49.15 39.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.564 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.76 -41.16 92.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.625 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.402 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 43.1 m -63.62 -50.35 69.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.574 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.58 -42.85 68.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.728 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -69.92 -27.05 64.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.81 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.5 tt -69.83 -49.11 55.73 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.017 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' A' ' 95' ' ' GLN . 7.2 mt -62.32 -50.9 69.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.123 0.487 . . . . 0.0 109.916 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.7 m -56.38 -34.2 66.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.725 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.18 -53.13 21.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.272 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 2.8 pp -68.63 -28.84 67.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.103 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.43 ' HB2' ' O ' ' A' ' 91' ' ' LEU . 10.0 tt0 -63.87 -54.13 39.68 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.864 0.364 . . . . 0.0 110.492 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -67.14 -29.52 69.25 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.58 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.03 -32.38 65.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.922 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -76.44 -42.32 44.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.753 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -68.88 -37.96 79.38 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.805 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -78.51 -38.4 40.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.015 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 62.73 -84.48 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.753 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 58.47 17.45 4.89 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.499 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 . . . . . 0 C--N 1.328 -0.343 0 CA-C-O 120.812 0.339 . . . . 0.0 110.979 -179.841 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.846 0.355 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.2 -167.88 47.89 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.579 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.89 77.67 1.1 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.678 2.252 . . . . 0.0 112.235 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -122.87 45.52 1.19 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.442 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.26 -39.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.903 0.382 . . . . 0.0 110.866 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.6 mp -58.57 -32.99 69.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.975 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.8 p -60.51 -47.63 91.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.335 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -59.81 -49.93 75.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.081 0.467 . . . . 0.0 110.349 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.427 HG13 ' CG2' ' A' ' 59' ' ' ILE . 10.7 t -56.85 -40.79 73.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.256 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -64.54 -37.57 94.59 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.479 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -56.86 -43.75 81.52 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.131 0.491 . . . . 0.0 109.897 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.415 HD22 ' CE1' ' A' ' 80' ' ' TYR . 0.2 OUTLIER -63.36 -40.15 96.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.732 178.909 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -53.82 -36.91 63.01 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.04 -42.63 84.48 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.675 178.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.55 -31.19 72.28 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.851 178.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.43 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 1.7 tp -63.58 -50.9 67.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.163 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.21 -34.44 72.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.176 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -45.27 94.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.312 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.452 ' CD1' ' CD2' ' A' ' 91' ' ' LEU . 7.7 m-85 -60.38 -44.1 95.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.232 179.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -57.24 -37.28 72.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.58 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -61.17 -55.15 35.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.362 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 39.5 t -57.82 -37.61 61.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.368 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.41 HG23 HG12 ' A' ' 48' ' ' VAL . 47.5 t -67.34 -43.7 87.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.853 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 m -55.81 -39.57 71.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.723 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.71 -27.74 68.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.031 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.401 ' CD2' ' HB3' ' A' ' 98' ' ' LYS . 44.2 mt -70.66 -40.27 73.11 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.999 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 63.61 14.16 7.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.41 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -138.42 158.45 44.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.688 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 58.7 30.53 65.88 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.27 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.597 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 1.6 mmtp -54.65 -52.08 73.12 Favored Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.597 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 11.0 Cg_endo -55.03 -49.28 17.13 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.447 2.098 . . . . 0.0 113.316 -179.092 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -59.66 -50.27 74.53 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.54 0.21 . . . . 0.0 111.436 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.571 ' O ' HG13 ' A' ' 52' ' ' ILE . 2.7 t -66.23 -55.39 19.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 120.841 0.353 . . . . 0.0 110.668 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.622 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 73.9 m-20 -52.7 -29.99 29.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.204 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -49.84 38.61 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -71.33 -45.96 61.73 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 48' ' ' VAL . 3.6 mt -57.13 -30.4 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.461 178.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.622 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -69.12 -50.87 44.06 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 178.634 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.4 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 14.7 m-20 -51.29 -38.69 54.21 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.385 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 27.9 mt -70.92 -43.4 68.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.084 179.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -56.65 -36.91 70.06 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.4 ' CD1' ' HA ' ' A' ' 54' ' ' ASN . 10.2 mt -70.98 -41.75 76.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.188 178.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 29.7 t -58.53 -52.1 67.07 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.519 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.427 ' CG2' HG13 ' A' ' 24' ' ' VAL . 36.8 mt -61.5 -52.64 58.73 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.661 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.415 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 1.4 t70 -56.55 -34.84 67.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.311 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.79 -49.22 78.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.852 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.658 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.3 mp -55.62 -56.56 18.87 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.041 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.437 ' H ' ' HG2' ' A' ' 63' ' ' MET . 0.0 OUTLIER -45.73 -54.44 7.89 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.762 0.315 . . . . 0.0 110.841 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.12 -24.44 66.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.918 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.1 mtmt -82.2 -30.06 31.09 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.223 0.535 . . . . 0.0 110.57 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -72.29 -33.74 47.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.983 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.0 mmtt -89.53 -24.11 21.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.051 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.418 ' C ' ' CG2' ' A' ' 69' ' ' THR . 58.3 m -115.38 19.08 15.74 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.418 ' CG2' ' C ' ' A' ' 68' ' ' SER . 0.1 OUTLIER -163.08 166.46 23.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.588 179.196 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -107.3 43.72 1.15 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.567 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -53.71 142.18 24.17 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.174 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.4 m -79.22 148.97 32.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.774 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.77 -31.15 68.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.594 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -59.22 -45.39 91.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.443 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -34.33 75.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.421 179.551 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 23.3 mm -71.49 -33.96 51.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.72 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -63.88 -51.75 63.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.783 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -60.94 -47.09 88.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.743 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -56.44 -33.17 65.6 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.415 ' CE1' HD22 ' A' ' 27' ' ' LEU . 4.6 t80 -64.32 -37.71 88.46 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -69.9 -37.67 76.05 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.15 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.32 -33.54 72.53 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 121.114 0.483 . . . . 0.0 109.873 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.7 mt -77.77 -30.96 51.7 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.05 178.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 52.7 t -69.42 -38.19 76.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.746 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -72.34 -46.93 53.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.732 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 m -68.94 -36.6 78.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.941 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.494 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 58.9 m -69.94 -51.12 35.36 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.039 -179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -55.39 -42.95 74.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.947 0.403 . . . . 0.0 110.797 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -71.31 -28.23 63.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.849 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.417 ' O ' ' CD2' ' A' ' 94' ' ' LEU . 1.5 tt -68.22 -50.21 55.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.297 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 87' ' ' SER . 5.8 mt -63.76 -41.57 97.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.361 0.6 . . . . 0.0 109.715 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.7 m -56.55 -39.79 74.01 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.767 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.83 -54.32 23.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.344 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.417 ' CD2' ' O ' ' A' ' 90' ' ' LEU . 0.3 OUTLIER -63.88 -25.93 68.38 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.798 179.83 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -40.03 77.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.96 0.409 . . . . 0.0 110.128 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.1 mtpt -64.14 -43.52 94.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.012 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.41 ' HG3' ' HA ' ' A' ' 94' ' ' LEU . 12.9 mttm -57.18 -47.34 81.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.952 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.401 ' HB3' ' CD2' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -75.78 -28.96 58.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.059 -179.801 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -70.83 -41.8 71.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.752 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -78.09 -28.99 48.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.107 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -90.7 46.24 1.32 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.147 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -161.94 -64.88 0.05 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.689 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.655 179.669 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.888 0.375 . . . . 0.0 110.995 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -177.62 56.56 0.1 OUTLIER Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.577 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.39 -177.77 3.96 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.686 2.257 . . . . 0.0 112.433 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 112.38 -43.48 1.71 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.616 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.7 t -104.25 -20.67 13.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.689 0.28 . . . . 0.0 111.183 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -54.84 -32.91 61.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.206 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.5 t -61.97 -52.57 58.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.173 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.69 -45.53 63.52 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.936 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.407 ' CG1' ' CE ' ' A' ' 63' ' ' MET . 30.6 t -60.1 -48.53 87.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.719 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.76 -39.71 98.29 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.011 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.1 m -56.7 -42.15 78.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.022 0.439 . . . . 0.0 110.236 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 20.1 tp -64.71 -41.35 96.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.145 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.7 ttmm -52.81 -39.35 62.32 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -65.05 -42.37 94.32 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.423 178.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.36 -31.6 72.8 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.824 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tt -61.97 -50.37 72.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.068 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -57.74 -38.83 76.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.164 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -57.89 -44.59 86.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.251 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -59.71 -43.19 94.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.394 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -56.48 -40.61 75.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.397 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.88 -52.07 66.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.278 179.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.2 t -59.76 -37.79 73.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.497 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.3 t -67.47 -43.86 87.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.802 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.8 m -61.95 -29.22 70.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.443 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.28 -31.43 71.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.845 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 pp -113.84 79.1 1.21 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.026 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.403 ' N ' ' HD3' ' A' ' 42' ' ' LYS . 6.4 mmtp -46.55 99.23 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.91 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.4 ' HB2' ' O ' ' A' ' 42' ' ' LYS . 33.9 t0 178.22 146.62 0.14 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.919 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.413 ' O ' HG13 ' A' ' 48' ' ' VAL . . . 50.79 42.2 45.42 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.706 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.56 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 7.8 mmtp -59.39 -51.62 80.06 Favored Pre-proline 0 C--N 1.329 -0.303 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.56 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 28.9 Cg_endo -63.78 -42.52 19.75 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.201 1.934 . . . . 0.0 112.943 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -65.15 -50.55 65.54 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.823 0.344 . . . . 0.0 111.193 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.597 ' O ' HG13 ' A' ' 52' ' ' ILE . 14.5 p -63.51 -55.23 24.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.598 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.59 ' HA ' HG13 ' A' ' 52' ' ' ILE . 60.3 m-20 -51.58 -31.2 23.8 Favored 'General case' 0 N--CA 1.461 0.116 0 CA-C-O 120.867 0.365 . . . . 0.0 110.702 179.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.09 -44.77 83.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.322 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -70.95 -48.7 51.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.269 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.597 HG13 ' O ' ' A' ' 48' ' ' VAL . 0.0 OUTLIER -57.46 -41.1 78.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.031 179.442 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -58.36 -52.43 65.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.684 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.0 m-20 -52.04 -39.81 60.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.944 0.402 . . . . 0.0 110.512 179.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 10.5 mt -68.39 -44.44 75.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.594 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.65 -36.38 69.46 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 10.5 mt -71.35 -42.48 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.289 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.8 m -60.4 -52.23 66.13 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.566 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 6.9 mt -58.13 -50.43 78.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.86 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -59.33 -37.16 77.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.813 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.66 -50.0 74.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.997 0.427 . . . . 0.0 110.676 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.657 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.0 OUTLIER -55.72 -55.44 32.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.547 179.372 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.407 ' CE ' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -44.9 -54.61 6.27 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.263 -179.848 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.78 -25.93 66.9 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.678 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.6 mtmp? -82.11 -29.49 31.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.024 0.44 . . . . 0.0 110.697 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.3 mm -73.12 -33.94 43.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.28 -179.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 14.3 mmtm -93.03 1.02 57.48 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.417 ' C ' ' CG2' ' A' ' 69' ' ' THR . 17.0 m -147.23 21.76 1.21 Allowed 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.417 ' CG2' ' C ' ' A' ' 68' ' ' SER . 0.2 OUTLIER -161.85 158.6 25.75 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.752 179.362 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -97.39 43.52 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.318 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.4 129.13 21.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.341 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.4 m -71.36 137.83 48.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.578 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.84 -30.29 22.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.717 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -59.34 -43.92 92.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.377 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 15.1 tp60 -68.05 -33.97 75.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.417 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 22.8 mm -69.58 -39.46 78.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.498 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -41.35 96.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.669 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.25 -48.24 68.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.453 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -56.57 -34.25 66.96 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -65.04 -36.81 85.55 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.407 -0.961 . . . . 0.0 108.407 177.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -69.84 -37.62 76.24 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.775 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.94 -33.61 72.13 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.0 mt -76.88 -32.39 57.44 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.105 179.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 43.2 t -69.52 -36.66 72.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.495 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.4 mmtm -72.13 -42.66 65.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.566 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.91 -35.65 64.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.492 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.42 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 34.8 m -68.59 -50.61 50.32 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.645 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -60.19 -38.7 84.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.323 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -65.85 -32.86 74.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.235 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.7 tt -64.66 -44.07 91.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.667 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.0 mt -62.09 -43.54 98.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.789 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 57.9 m -54.66 -46.68 74.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.449 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.3 -40.71 97.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.415 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 mp -57.72 -49.75 75.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.56 179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.83 -42.33 75.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.592 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.13 -38.6 80.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.571 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.447 ' HA ' ' HG2' ' A' ' 100' ' ' GLN . 7.2 mttt -62.13 -46.12 90.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.371 0.605 . . . . 0.0 111.069 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -65.06 -53.55 43.98 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.661 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -63.73 -32.14 73.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.055 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.447 ' HG2' ' HA ' ' A' ' 97' ' ' LYS . 3.8 pt20 -79.65 -39.75 30.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.77 0.319 . . . . 0.0 111.185 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -68.88 -56.85 6.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.026 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 61.04 116.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.881 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.337 -179.646 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.83 0.348 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 122.38 164.58 12.21 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.532 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.35 138.81 36.78 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.699 2.266 . . . . 0.0 112.302 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -176.16 44.91 0.11 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.308 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.2 p -178.28 -38.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.872 0.368 . . . . 0.0 110.829 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.6 mt -54.6 -32.76 59.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.95 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.9 p -59.13 -47.06 91.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.022 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.6 tttt -61.54 -41.98 98.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.077 0.465 . . . . 0.0 110.3 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.8 t -57.03 -44.88 83.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.49 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.17 -37.69 94.92 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.711 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.44 -44.57 84.82 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.895 0.378 . . . . 0.0 110.222 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 20.0 tp -62.65 -41.79 99.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.088 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.3 tptt -53.28 -38.5 63.15 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.9 mptt -65.15 -40.67 94.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.32 178.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -63.44 -31.32 72.45 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.739 178.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.4 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.2 OUTLIER -63.09 -49.09 75.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.103 179.143 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -59.48 -37.0 77.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.315 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -50.24 73.56 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.332 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.448 ' CD1' ' CD2' ' A' ' 91' ' ' LEU . 4.1 m-85 -58.78 -45.51 89.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.619 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -51.56 -43.8 62.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.02 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -61.43 -53.92 50.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.566 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 33.5 t -58.63 -37.7 66.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.767 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.407 ' CG2' ' CD2' ' A' ' 94' ' ' LEU . 39.3 t -71.08 -40.46 75.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.081 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.44 -38.39 77.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.86 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.32 -20.05 63.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.436 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 44.4 mt -75.33 -42.48 54.29 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.211 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.61 14.0 7.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.439 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -131.68 146.53 52.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.704 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 57.22 27.93 58.22 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.334 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.621 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 0.6 OUTLIER -61.92 -49.33 86.08 Favored Pre-proline 0 C--N 1.329 -0.313 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.716 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.621 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 10.8 Cg_endo -55.0 -45.48 40.59 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.146 1.897 . . . . 0.0 112.954 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.439 ' O ' ' HG3' ' A' ' 50' ' ' ARG . 11.8 pt-20 -70.06 -50.73 38.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.768 0.318 . . . . 0.0 111.479 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.598 ' O ' HG13 ' A' ' 52' ' ' ILE . 8.3 p -62.04 -55.29 25.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.718 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.573 ' HA ' HG13 ' A' ' 52' ' ' ILE . 98.2 m-20 -51.59 -43.79 62.58 Favored 'General case' 0 N--CA 1.463 0.204 0 O-C-N 123.078 0.236 . . . . 0.0 111.399 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.517 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -60.78 -36.04 77.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.773 0.32 . . . . 0.0 110.682 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.517 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 44.6 mt-30 -74.42 -48.57 26.87 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.219 0.533 . . . . 0.0 109.973 179.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.598 HG13 ' O ' ' A' ' 48' ' ' VAL . 0.0 OUTLIER -57.56 -38.86 66.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.923 179.319 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.423 ' O ' HG13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -61.45 -53.2 59.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.597 179.507 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.402 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 17.6 m-20 -51.54 -36.52 45.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.786 0.327 . . . . 0.0 110.724 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.7 mt -72.93 -45.54 57.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.82 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.433 ' HG3' ' N ' ' A' ' 57' ' ' ILE . 0.4 OUTLIER -56.74 -33.11 66.23 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.779 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.433 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 14.5 mt -71.26 -44.19 73.51 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.188 178.311 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.1 m -59.11 -46.67 87.71 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.377 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.7 mt -58.46 -55.07 24.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.732 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -57.9 -33.73 69.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.543 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.84 -49.97 74.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.206 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.665 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.0 OUTLIER -55.89 -54.64 42.14 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.264 179.045 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.03 -54.95 6.04 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.255 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.27 -25.17 66.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.649 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 24.1 mtpt -82.29 -29.97 30.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.166 0.508 . . . . 0.0 110.62 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.665 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -71.99 -34.06 49.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.092 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.64 1.16 55.56 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.238 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 58.3 m -138.87 21.91 2.65 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.3 p -160.16 179.61 8.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.869 0.366 . . . . 0.0 110.73 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.58 37.36 3.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.565 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 16.7 mmm -56.0 146.18 23.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.125 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.2 m -84.97 142.41 29.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.755 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.99 -29.81 57.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.707 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -46.39 89.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.451 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.46 -34.23 75.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.436 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.431 HG22 HD12 ' A' ' 76' ' ' ILE . 27.0 mm -70.58 -33.87 55.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.77 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 8.4 tp60 -66.46 -42.65 87.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.872 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.59 -50.9 56.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.72 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -56.37 -34.09 66.33 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -64.55 -35.65 81.66 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -69.55 -37.52 77.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.963 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.25 -37.27 77.15 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.313 0.578 . . . . 0.0 109.589 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 26.3 mt -75.51 -30.71 59.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.101 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 61.7 t -69.17 -34.57 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.53 179.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.16 -49.11 38.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.464 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 m -68.1 -36.85 80.45 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.568 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.0 t -66.64 -50.33 63.3 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.811 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -58.79 -36.0 73.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.487 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.19 -31.42 68.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.73 179.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.5 tt -66.34 -49.05 68.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.993 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.448 ' CD2' ' CD1' ' A' ' 34' ' ' PHE . 7.0 mt -60.71 -49.09 78.89 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.143 0.497 . . . . 0.0 109.848 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.2 m -55.73 -42.72 75.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.662 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.77 -52.25 63.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.685 179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.407 ' CD2' ' CG2' ' A' ' 38' ' ' VAL . 4.6 mp -57.45 -42.68 82.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.756 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -55.59 -43.88 76.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.611 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.7 mtmt -66.35 -29.64 69.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.031 0.443 . . . . 0.0 109.835 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -71.29 -53.2 15.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.458 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -45.57 94.05 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.152 -179.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -59.44 -42.54 92.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.743 0.306 . . . . 0.0 110.69 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -69.72 -36.03 75.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.504 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 45.29 27.65 0.37 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.834 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 61.07 116.9 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.043 0.449 . . . . 0.0 111.036 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 . . . . . 0 C--N 1.321 -0.644 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.441 -179.825 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.873 0.368 . . . . 0.0 110.996 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.45 -101.72 1.9 Allowed Glycine 0 CA--C 1.519 0.331 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.614 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.73 163.0 39.7 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.495 2.13 . . . . 0.0 112.339 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 139.64 -69.92 0.47 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.587 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.4 p -93.12 -25.05 18.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.769 0.319 . . . . 0.0 111.14 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.9 mt -54.69 -32.89 60.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.161 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.0 p -63.98 -46.5 93.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.412 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.8 mttm -56.73 -50.52 71.96 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.019 0.438 . . . . 0.0 110.674 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.5 t -57.04 -39.96 69.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.116 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.1 -37.15 93.81 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.595 179.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.1 m -57.02 -47.28 81.28 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.078 0.466 . . . . 0.0 110.084 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.417 HD12 ' CE1' ' A' ' 80' ' ' TYR . 4.1 tt -61.53 -38.7 88.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.818 179.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -54.92 -37.8 66.84 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 178.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.0 -41.85 95.0 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.33 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.26 -30.48 71.62 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.795 178.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.412 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 0.3 OUTLIER -63.0 -52.35 63.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.101 179.312 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -57.93 -36.06 71.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.076 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.99 -44.55 91.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.244 179.305 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.412 ' CD2' ' HA ' ' A' ' 31' ' ' LEU . 13.1 m-85 -61.18 -43.37 98.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.346 179.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.8 m-20 -54.09 -44.67 71.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.534 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -59.26 -54.32 48.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.062 0.458 . . . . 0.0 110.439 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.4 t -55.89 -37.78 49.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.49 179.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.435 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 48.8 t -69.58 -40.86 80.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.618 179.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.8 t -63.72 -23.29 67.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.334 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.05 -38.75 92.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.564 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.435 ' CD2' ' HA ' ' A' ' 38' ' ' VAL . 0.5 OUTLIER -88.81 -34.23 17.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.682 0.277 . . . . 0.0 111.23 -179.836 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.86 10.02 6.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.756 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -103.76 103.28 13.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.78 0.324 . . . . 0.0 111.071 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 101.11 53.67 1.0 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.575 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.505 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 2.2 mmtt -66.69 -57.27 12.28 Favored Pre-proline 0 C--N 1.327 -0.388 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.505 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 13.8 Cg_endo -56.88 -49.47 14.39 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.47 2.113 . . . . 0.0 112.974 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.27 -50.14 72.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.826 0.346 . . . . 0.0 111.213 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 52' ' ' ILE . 50.7 t -64.59 -55.57 20.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.706 179.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.42 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 85.3 m-20 -55.46 -25.57 37.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.092 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.32 -49.44 34.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.861 0.362 . . . . 0.0 111.585 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -76.62 -44.56 33.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.492 0.663 . . . . 0.0 109.753 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.8 mt -57.62 -35.34 50.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.337 179.096 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -69.4 -51.71 33.91 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.591 179.283 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.433 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 16.4 m-20 -50.99 -34.46 29.2 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.712 0.291 . . . . 0.0 110.513 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.7 mt -75.81 -43.49 45.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.315 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.86 -36.41 70.01 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.433 ' CD1' ' HA ' ' A' ' 54' ' ' ASN . 12.2 mt -68.51 -40.73 82.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 114.937 -1.028 . . . . 0.0 109.946 178.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.8 m -57.48 -45.62 84.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.482 179.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.6 mt -60.23 -50.72 79.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.398 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.431 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 72.7 m-20 -57.08 -31.68 65.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.166 179.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.25 -49.32 74.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.672 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.663 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.6 mp -56.16 -56.99 14.17 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.023 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.431 ' CG ' ' HA ' ' A' ' 60' ' ' ASP . 0.0 OUTLIER -46.44 -50.72 16.4 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.7 0.286 . . . . 0.0 110.841 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.07 -24.44 67.7 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.753 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.9 mtpt -82.45 -29.36 30.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.113 0.482 . . . . 0.0 110.557 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.663 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -73.07 -37.13 52.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.201 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 5.5 mmmt -93.96 -27.46 16.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.542 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.429 ' O ' ' CG2' ' A' ' 69' ' ' THR . 1.2 t -105.67 24.96 11.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.699 0.285 . . . . 0.0 111.411 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.429 ' CG2' ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 174.66 155.06 0.14 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.887 179.746 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 5.9 mtm -107.73 69.27 0.73 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.907 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 9.2 ptm -72.11 173.29 8.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.791 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.43 141.96 28.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.066 -179.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.08 -29.89 67.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.714 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -58.01 -40.25 80.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.725 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -35.04 79.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.52 179.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 27.0 mm -67.96 -37.54 78.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.833 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 4.0 tp60 -66.68 -52.12 48.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.853 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -45.67 85.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.731 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -56.56 -35.13 67.81 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.417 ' CE1' HD12 ' A' ' 27' ' ' LEU . 11.2 t80 -64.21 -38.08 89.76 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 177.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -69.97 -35.79 74.72 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.09 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.42 79.2 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.242 0.544 . . . . 0.0 109.75 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 6.5 mt -74.45 -31.25 62.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.045 178.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 61.4 t -69.57 -38.99 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.356 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -66.13 -49.14 68.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.377 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 74.7 m -68.27 -38.06 81.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.407 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.424 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 24.3 m -65.7 -50.37 65.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.692 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.89 -43.58 73.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.985 0.421 . . . . 0.0 110.728 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -67.56 -29.12 68.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.707 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.1 tt -67.92 -48.89 64.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.064 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 87' ' ' SER . 7.0 mt -61.03 -52.44 64.94 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.057 0.456 . . . . 0.0 110.076 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.4 m -58.58 -38.32 77.66 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.662 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.25 -36.06 76.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.875 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.23 -42.42 72.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.856 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.438 ' HA ' ' HD3' ' A' ' 98' ' ' LYS . 0.1 OUTLIER -59.01 -54.25 49.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.686 179.825 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.6 mtpp -63.78 -28.9 70.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.37 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.5 tttp -67.14 -34.57 77.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.161 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 95' ' ' GLN . 0.2 OUTLIER -74.95 -53.87 8.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.887 0.375 . . . . 0.0 111.104 -179.901 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.68 -26.37 67.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.557 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -78.88 -53.05 7.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.096 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 58.92 -86.23 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.57 -179.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -158.72 98.57 1.51 Allowed 'General case' 0 CA--C 1.52 -0.173 0 CA-C-O 120.979 0.419 . . . . 0.0 110.549 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 C--N 1.323 -0.567 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.598 179.573 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 . . . . . 0 N--CA 1.457 -0.085 0 CA-C-O 120.873 0.368 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -156.94 -177.89 30.49 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.543 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.19 -167.73 0.26 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.591 2.194 . . . . 0.0 112.338 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.79 -42.46 1.91 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.376 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.2 t -109.74 -35.28 6.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.831 0.348 . . . . 0.0 110.799 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.5 -32.73 72.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.933 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.5 p -61.18 -47.98 91.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.254 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.45 -37.91 79.36 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.912 0.387 . . . . 0.0 110.589 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 19.8 t -58.67 -50.61 78.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.395 179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.15 -40.45 97.23 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.644 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.633 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -57.02 -37.99 72.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.08 0.466 . . . . 0.0 110.022 179.292 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.97 -42.83 94.23 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 178.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.75 -35.78 56.74 Favored 'General case' 0 C--N 1.333 -0.128 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.633 ' HG3' ' HA ' ' A' ' 26' ' ' THR . 23.2 mttt -61.69 -45.64 93.1 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.592 178.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -36.96 71.55 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.316 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.1 mp -61.36 -51.2 69.8 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.491 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -57.94 -37.04 73.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.296 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.8 tptt -58.86 -43.2 90.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.263 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.446 ' CE1' ' CD2' ' A' ' 91' ' ' LEU . 13.0 m-85 -63.91 -41.39 97.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.612 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 45.5 m-20 -55.19 -44.19 75.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.872 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -62.72 -54.29 41.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.766 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 33.7 t -57.71 -38.22 63.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.06 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 47.9 t -75.07 -35.45 34.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.885 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.4 p -60.78 -34.02 73.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.531 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.11 -21.42 59.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.269 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.5 mt -71.45 -41.28 69.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.93 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.67 13.81 7.66 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.567 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -131.06 135.56 47.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.92 0.391 . . . . 0.0 110.898 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 59.05 57.27 20.73 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.488 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.498 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 3.7 mmmm -77.45 -45.09 2.62 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 120.508 0.194 . . . . 0.0 111.348 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.498 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 50.2 Cg_exo -53.68 -42.36 66.75 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.256 1.971 . . . . 0.0 112.475 -179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -60.64 -50.23 74.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.921 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.532 ' O ' HG13 ' A' ' 52' ' ' ILE . 5.1 t -65.92 -55.21 20.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.082 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.596 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 97.4 m-20 -52.85 -31.11 37.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.362 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 26.4 ttm180 -73.06 -47.89 40.74 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -73.01 -41.27 64.44 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.621 0.724 . . . . 0.0 109.41 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.532 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.4 mt -61.87 -31.54 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.082 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.596 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -70.16 -55.05 10.35 Favored 'General case' 0 N--CA 1.46 0.055 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.366 179.54 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.426 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 28.5 p30 -59.83 -25.42 64.98 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.989 -179.512 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 71.9 mt -77.54 -46.74 21.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.514 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.49 ' HG3' ' N ' ' A' ' 57' ' ' ILE . 0.1 OUTLIER -57.0 -32.88 66.57 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.957 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.49 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 13.6 mt -71.4 -41.43 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.063 178.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 69.1 m -57.46 -47.6 81.42 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.214 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 11.7 mt -59.78 -49.83 82.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.271 179.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.79 -32.58 71.92 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.114 179.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.83 -49.86 75.22 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.96 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.655 ' O ' HG12 ' A' ' 66' ' ' ILE . 0.8 OUTLIER -55.72 -53.62 54.41 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.2 178.89 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.28 -56.44 4.87 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.018 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.62 -24.07 65.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.607 179.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.07 -29.19 31.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.233 0.539 . . . . 0.0 110.415 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.655 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.8 mm -73.46 -41.11 56.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.499 -179.302 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.75 -29.51 16.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.875 -179.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.413 ' O ' ' CG2' ' A' ' 69' ' ' THR . 0.8 OUTLIER -102.32 24.23 10.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.693 0.282 . . . . 0.0 111.713 -179.387 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.413 ' CG2' ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 177.57 149.82 0.18 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.935 179.523 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.4 mtm -76.06 63.22 1.77 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.957 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.51 125.77 25.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.788 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.1 m -78.11 135.54 37.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.799 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.86 -33.71 50.98 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.871 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.39 -47.51 83.64 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.347 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.15 -32.92 74.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.353 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.475 HG22 HD13 ' A' ' 76' ' ' ILE . 26.1 mm -71.58 -38.69 68.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.695 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -52.18 66.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.634 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.58 -47.04 80.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.485 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -56.54 -34.06 66.71 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -64.24 -37.26 86.86 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -69.67 -36.7 76.26 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.978 178.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.49 -36.07 75.34 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.146 0.498 . . . . 0.0 109.688 179.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.2 mt -76.74 -31.25 56.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.004 178.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 54.0 t -69.55 -34.83 63.49 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.466 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.8 tptp -71.99 -49.26 38.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.408 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 11.6 m -66.71 -43.7 83.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.406 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 98.5 p -61.51 -48.46 80.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.505 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -55.28 -41.04 71.73 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.702 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.98 -34.36 78.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.602 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 tt -63.36 -46.3 87.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.791 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.446 ' CD2' ' CE1' ' A' ' 34' ' ' PHE . 6.3 mt -63.75 -47.47 80.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.129 0.49 . . . . 0.0 109.825 179.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 33.8 p -56.52 -39.51 73.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.564 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.99 -47.03 75.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.592 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 85.7 mt -57.2 -44.78 83.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.632 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -39.85 86.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.368 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.4 mttt -64.22 -29.15 70.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.853 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.4 -58.46 3.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.309 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.26 -48.01 81.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.314 -179.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -60.15 -38.06 81.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.843 0.354 . . . . 0.0 110.771 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -62.64 -37.4 86.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.745 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -132.21 96.88 3.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.874 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -67.59 -26.32 66.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.043 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.361 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 . . . . . 0 C--O 1.233 0.216 0 CA-C-O 120.823 0.344 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 167.03 -95.01 0.11 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.422 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.58 -167.87 0.36 Allowed 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.519 2.146 . . . . 0.0 112.262 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.27 -41.21 2.2 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.519 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 p -87.83 -23.19 24.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.84 0.352 . . . . 0.0 111.178 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 20.4 mt -54.01 -33.0 55.96 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.074 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.3 p -60.78 -45.91 97.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.042 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 80' ' ' TYR . 0.1 OUTLIER -60.44 -46.81 88.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.058 0.456 . . . . 0.0 110.587 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.419 ' CG1' ' HE2' ' A' ' 63' ' ' MET . 19.4 t -56.97 -44.78 83.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.419 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.89 -36.41 92.78 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.707 -0.759 . . . . 0.0 111.68 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.3 m -57.98 -47.51 82.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.913 0.387 . . . . 0.0 110.186 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 12.8 mt -60.84 -39.04 87.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.078 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.55 -40.62 68.88 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.57 -37.23 86.84 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.387 178.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.405 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -62.04 -33.4 74.3 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.726 178.979 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.4 mt -65.26 -48.86 71.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.022 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -57.75 -42.06 83.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.195 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.4 tptt -61.08 -41.93 97.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.047 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.429 ' CE2' HD22 ' A' ' 91' ' ' LEU . 4.0 m-30 -60.73 -45.44 94.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.366 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 12.6 m-20 -58.65 -36.45 74.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.615 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -61.42 -55.29 32.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.479 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 36.6 t -58.97 -37.93 70.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.67 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.3 t -70.82 -37.79 70.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.871 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.56 -36.88 79.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.426 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.34 -12.77 60.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.387 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 52.3 mt -85.98 -55.52 3.91 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.965 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.13 3.73 4.44 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.649 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -114.09 126.64 55.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.781 0.324 . . . . 0.0 110.692 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.89 31.93 54.59 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.326 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.522 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 6.8 mmtt -48.1 -57.31 10.72 Favored Pre-proline 0 C--N 1.331 -0.236 0 N-CA-C 111.606 0.224 . . . . 0.0 111.606 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.522 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 10.6 Cg_endo -54.1 -49.19 17.9 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.524 2.149 . . . . 0.0 112.513 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -53.34 -49.71 66.55 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.017 0.437 . . . . 0.0 111.264 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.632 ' O ' HG13 ' A' ' 52' ' ' ILE . 2.5 t -67.64 -55.23 17.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.92 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.563 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 79.5 m-20 -52.66 -35.7 55.48 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.485 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 11.6 ptt85 -73.65 -38.96 64.82 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.485 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 61.7 mt-30 -75.94 -47.75 23.95 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.731 0.777 . . . . 0.0 109.163 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.632 HG13 ' O ' ' A' ' 48' ' ' VAL . 3.6 mt -57.03 -32.14 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 114.555 -1.202 . . . . 0.0 110.09 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.563 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.4 OUTLIER -69.13 -52.99 22.54 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.418 179.011 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.1 m-20 -50.99 -34.31 28.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.875 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 26.4 mt -76.0 -45.96 31.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.96 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.455 ' HG3' ' N ' ' A' ' 57' ' ' ILE . 0.4 OUTLIER -56.65 -31.91 64.83 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.915 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.455 ' N ' ' HG3' ' A' ' 56' ' ' GLU . 16.8 mt -71.34 -44.79 72.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.055 178.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.6 m -60.27 -52.41 65.39 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.355 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 71.6 mt -58.24 -51.43 71.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.585 179.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.16 -33.52 71.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.206 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.64 -49.49 76.28 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.962 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.662 ' O ' HG12 ' A' ' 66' ' ' ILE . 0.8 OUTLIER -55.33 -52.51 63.24 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.16 178.912 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.419 ' HE2' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -44.96 -58.55 3.08 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.02 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.24 -24.2 62.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.576 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.18 -29.66 31.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.141 0.496 . . . . 0.0 110.562 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.662 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.2 mm -70.49 -40.45 77.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.237 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.27 1.23 51.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.17 -179.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.5 m -132.95 21.18 4.13 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 120.748 -0.381 . . . . 0.0 112.018 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -160.34 -175.34 4.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.858 0.361 . . . . 0.0 110.833 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -126.55 33.42 4.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.392 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.1 mmm -56.91 149.98 17.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.999 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.7 m -80.67 143.94 32.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.904 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.81 -30.77 58.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.64 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -58.08 -46.26 85.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.39 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.06 -35.68 73.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.203 179.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.449 HD13 HG22 ' A' ' 76' ' ' ILE . 18.4 mm -69.54 -33.97 59.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.489 179.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' A' ' 80' ' ' TYR . 8.0 tp-100 -61.83 -49.44 76.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.468 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 mmtt -62.59 -41.61 99.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.273 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -57.69 -36.22 71.67 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 23' ' ' LYS . 14.5 m-85 -64.32 -35.9 82.38 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 177.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -69.44 -37.58 77.43 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.026 178.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.46 -34.62 75.76 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.24 0.543 . . . . 0.0 109.61 178.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.4 mt -76.87 -30.26 56.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.06 178.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 66.4 t -68.12 -35.76 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.41 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.7 tptt -72.44 -49.26 34.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.599 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.9 m -66.03 -43.11 88.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.518 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 96.3 p -62.38 -46.7 87.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.525 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -55.94 -41.26 74.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.634 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.96 -32.12 73.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.704 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.408 HD21 ' CE2' ' A' ' 34' ' ' PHE . 7.9 tt -63.97 -47.8 78.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.046 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.429 HD22 ' CE2' ' A' ' 34' ' ' PHE . 7.6 mt -60.59 -52.55 64.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.109 0.481 . . . . 0.0 109.925 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 69.8 m -54.93 -38.63 67.91 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.487 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.412 ' HA ' ' HG2' ' A' ' 96' ' ' LYS . . . -68.93 -36.17 77.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.621 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.9 tp -66.29 -49.06 68.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.745 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 75.6 mm-40 -55.92 -48.92 74.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.613 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.412 ' HG2' ' HA ' ' A' ' 93' ' ' ALA . 9.0 pttt -62.84 -28.62 70.14 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.89 -55.39 13.02 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.599 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 0.1 OUTLIER -62.28 -44.08 97.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.605 -179.067 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.406 ' HG2' ' HA ' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -66.42 -31.02 71.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.573 0.225 . . . . 0.0 111.065 -179.698 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -78.15 -52.67 8.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.778 0.323 . . . . 0.0 110.765 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -74.68 79.8 2.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.789 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -145.64 -47.0 0.21 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.933 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.929 179.93 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.903 0.382 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.93 108.82 1.2 Allowed Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.616 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.98 77.19 1.17 Allowed 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.406 2.071 . . . . 0.0 112.22 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -124.64 7.75 8.34 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.926 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -112.29 -28.83 7.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.738 0.304 . . . . 0.0 111.025 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 5.0 mt -53.78 -32.84 53.97 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.061 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.6 p -67.8 -45.15 84.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.97 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? -63.43 -52.98 59.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.928 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.408 HG11 ' CE ' ' A' ' 63' ' ' MET . 23.7 t -56.76 -46.97 83.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.578 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -58.83 -40.22 94.84 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.511 -0.852 . . . . 0.0 111.419 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 48.4 m -57.18 -38.96 74.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.063 0.459 . . . . 0.0 109.925 179.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 15.8 tp -62.84 -44.06 97.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.878 179.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.95 -39.6 63.03 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -36.2 83.55 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.582 178.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.43 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -65.62 -33.61 76.3 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.876 179.024 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.96 -42.02 94.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.945 179.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.28 -49.39 77.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.832 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.451 ' HG3' ' N ' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -57.86 -35.78 71.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.823 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.451 ' N ' ' HG3' ' A' ' 33' ' ' LYS . 15.7 m-85 -65.62 -39.87 91.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.891 0.376 . . . . 0.0 110.411 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -61.33 -40.61 94.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.379 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -53.66 54.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.363 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.6 t -57.54 -37.96 61.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.723 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 77.2 t -71.18 -39.41 73.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.892 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.84 -37.16 75.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.74 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.76 -17.98 65.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.426 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 24.4 mt -79.93 -34.64 38.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.148 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER 64.77 12.69 7.87 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.476 -179.741 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -133.82 155.28 50.11 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.814 0.34 . . . . 0.0 110.766 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 57.8 27.79 59.6 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.32 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.515 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 1.1 mmtt -55.73 -57.21 22.69 Favored Pre-proline 0 C--N 1.329 -0.306 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 11.7 Cg_endo -55.69 -49.09 16.96 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.428 2.085 . . . . 0.0 112.68 -179.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -55.49 -48.95 73.78 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.069 0.461 . . . . 0.0 111.074 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.578 ' O ' HG13 ' A' ' 52' ' ' ILE . 18.8 t -67.19 -50.06 66.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.256 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -59.06 -33.09 70.38 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.484 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 8.1 ptp180 -73.51 -40.21 64.21 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.442 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.484 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 31.7 mt-30 -75.98 -49.77 16.74 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.578 HG13 ' O ' ' A' ' 48' ' ' VAL . 2.0 mt -56.89 -29.91 32.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.005 178.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.462 ' HA ' ' HG2' ' A' ' 56' ' ' GLU . 32.2 tttt -69.26 -53.17 21.16 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.159 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.405 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 8.4 m-20 -53.17 -32.39 47.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.843 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 55.6 mt -74.51 -47.82 30.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.305 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.462 ' HG2' ' HA ' ' A' ' 53' ' ' LYS . 3.5 pt-20 -56.21 -31.79 63.8 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.413 HG13 ' O ' ' A' ' 53' ' ' LYS . 15.6 mt -71.04 -43.26 76.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.897 178.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m -58.48 -46.96 85.57 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.255 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.401 ' CG2' HG11 ' A' ' 24' ' ' VAL . 55.5 mt -60.08 -55.56 23.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.458 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.2 -34.12 68.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.245 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.8 -49.17 76.14 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.197 0.522 . . . . 0.0 109.899 179.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.677 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.2 mp -55.09 -48.77 73.1 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.867 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.408 ' CE ' HG11 ' A' ' 24' ' ' VAL . 12.5 mmt -44.85 -59.84 2.34 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.764 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.94 -23.58 61.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.589 179.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.405 ' O ' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -82.03 -29.0 32.19 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.293 0.568 . . . . 0.0 110.538 179.37 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.677 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.3 mm -73.41 -45.7 51.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.913 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.3 -32.43 17.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.013 -178.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.431 ' O ' ' CG2' ' A' ' 69' ' ' THR . 0.3 OUTLIER -98.08 22.18 9.78 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.233 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.431 ' CG2' ' O ' ' A' ' 68' ' ' SER . 0.6 OUTLIER 179.36 149.75 0.29 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.817 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -78.9 61.2 3.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.951 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.07 120.59 10.57 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.806 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.2 m -65.32 132.71 49.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.774 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.34 -31.51 54.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.83 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -61.33 -45.75 93.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.437 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.42 -33.72 75.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.424 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.45 HD13 HG21 ' A' ' 76' ' ' ILE . 20.9 mm -68.53 -33.88 62.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.787 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -67.8 -48.69 65.58 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.856 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -49.02 70.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.578 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -56.61 -33.54 66.35 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 178.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -64.89 -35.62 81.73 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 177.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -69.54 -37.05 76.92 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.93 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.5 -35.38 75.8 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 121.28 0.562 . . . . 0.0 109.633 178.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.1 mt -75.51 -31.57 60.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.082 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 75.6 t -67.71 -34.64 69.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.386 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? -72.15 -49.42 36.01 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.277 179.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 69.6 m -63.4 -41.67 98.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.18 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.1 t -62.94 -50.0 72.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.321 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -50.59 -42.37 55.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.564 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -70.64 -29.17 65.46 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.636 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 tt -67.86 -49.23 63.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.948 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.45 ' CD2' ' CE1' ' A' ' 34' ' ' PHE . 6.8 mt -61.78 -46.64 88.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.128 0.49 . . . . 0.0 109.797 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 12.1 p -54.94 -42.52 72.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.452 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.84 -47.33 81.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.348 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 mt -59.03 -45.15 91.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.439 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -55.83 -39.39 71.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.333 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.12 -30.84 70.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.818 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 43.6 mttt -68.5 -54.0 19.61 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.958 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.54 -37.18 85.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.876 0.37 . . . . 0.0 110.786 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -59.43 -42.35 91.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.658 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -78.0 -48.98 14.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.711 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -67.1 -172.59 0.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.777 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -70.7 132.28 45.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.903 0.383 . . . . 0.0 110.784 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.139 179.768 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 40.6 mm-40 . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.786 0.327 . . . . 0.0 111.038 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 169.01 62.67 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.552 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -82.94 53.68 4.49 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.744 2.296 . . . . 0.0 112.44 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -175.31 -46.04 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.515 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.1 p -57.45 -29.46 64.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.884 0.373 . . . . 0.0 110.945 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.0 mt -60.14 -32.86 71.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.86 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 40.4 t -59.83 -52.33 62.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.096 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -53.76 -46.41 70.92 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.009 0.433 . . . . 0.0 110.657 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.4 ' CG1' ' CE ' ' A' ' 63' ' ' MET . 10.7 t -59.45 -43.24 90.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.436 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.93 -36.26 91.84 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.604 -0.808 . . . . 0.0 111.763 179.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -49.06 76.98 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.98 0.419 . . . . 0.0 110.218 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.412 ' HG ' ' CE2' ' A' ' 80' ' ' TYR . 6.6 mt -62.16 -38.8 90.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.945 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -53.68 -37.79 63.56 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.42 -40.53 81.17 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.793 178.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -62.54 -36.91 84.11 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.046 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -62.61 -48.42 79.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.256 179.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -59.99 -35.07 74.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.361 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -60.59 -46.08 91.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.341 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -62.59 -41.16 98.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.415 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -57.84 -38.22 75.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.885 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.11 -54.39 30.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.554 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 29.1 t -58.33 -38.24 68.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.779 179.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 45.2 t -74.99 -35.83 36.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.882 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.1 m -59.91 -34.88 73.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.633 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.55 -16.44 60.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.301 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.416 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 82.6 mt -75.51 -45.97 35.07 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.127 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 1.4 mptt 68.31 8.43 6.6 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.53 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -127.38 150.15 49.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.716 0.293 . . . . 0.0 110.684 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 57.16 34.03 65.98 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.267 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.513 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 3.8 mmtp -63.01 -44.3 84.49 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.423 0.154 . . . . 0.0 111.389 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.513 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 32.2 Cg_exo -58.78 -49.18 12.22 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.495 2.13 . . . . 0.0 112.864 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -64.59 -50.09 68.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.734 0.302 . . . . 0.0 111.704 -179.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.564 ' O ' HG13 ' A' ' 52' ' ' ILE . 14.7 p -66.88 -46.75 84.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.186 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -60.24 -28.98 68.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.833 0.349 . . . . 0.0 110.759 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 20.9 ttt-85 -74.16 -47.11 38.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.42 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -72.37 -46.15 56.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.607 0.717 . . . . 0.0 109.268 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.2 mt -57.48 -39.45 68.97 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-N 114.646 -1.161 . . . . 0.0 110.459 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.46 ' O ' HG12 ' A' ' 57' ' ' ILE . 1.2 tmtt? -64.34 -47.78 78.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.592 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.452 ' HA ' HG12 ' A' ' 57' ' ' ILE . 14.2 m-20 -51.5 -49.18 62.37 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.707 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.2 mt -58.98 -40.73 85.7 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -29.68 63.48 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.164 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 53' ' ' LYS . 5.3 mm -71.19 -43.52 74.81 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.236 178.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 28.3 t -57.94 -52.98 63.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.666 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.4 mt -58.38 -52.79 54.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.943 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.53 -36.47 71.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.492 179.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.99 -49.31 76.15 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.37 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.663 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.7 mp -55.21 -52.51 63.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.537 179.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.4 ' CE ' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.03 -55.93 5.12 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.131 179.853 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.53 -24.28 66.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.65 179.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.407 ' O ' ' OG1' ' A' ' 69' ' ' THR . 9.3 mtpt -82.06 -29.06 32.06 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-O 121.135 0.493 . . . . 0.0 110.488 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.663 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.1 mm -71.64 -39.5 69.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.225 -179.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -93.11 -28.28 16.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.695 -179.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.417 ' O ' ' CG2' ' A' ' 69' ' ' THR . 0.3 OUTLIER -103.73 24.25 11.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.759 0.314 . . . . 0.0 111.753 -179.553 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.417 ' CG2' ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 176.92 150.09 0.15 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.057 179.488 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 1.9 mpp? -76.01 69.69 2.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.991 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.57 125.65 27.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.774 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.65 142.89 33.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.794 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.66 -35.12 60.68 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.938 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -59.28 -47.3 85.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.682 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -59.92 -32.48 70.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.465 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.434 HD12 HG23 ' A' ' 76' ' ' ILE . 26.9 mm -72.0 -34.27 50.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.702 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.22 -46.04 85.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.684 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -49.24 66.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.549 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -56.5 -34.35 66.89 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.412 ' CE2' ' HG ' ' A' ' 27' ' ' LEU . 16.9 t80 -64.73 -35.34 80.73 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 177.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -69.26 -37.52 77.98 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.954 178.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.19 -36.9 78.66 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 178.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mt -75.48 -30.48 59.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.948 178.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 93.2 t -67.88 -35.0 70.65 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.288 179.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.02 -49.38 37.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.206 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.9 -34.7 79.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.129 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.405 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 3.2 m -65.25 -46.35 80.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.286 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -56.36 -44.93 80.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.593 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -65.56 -30.68 71.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.689 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.423 ' CD1' HG12 ' A' ' 52' ' ' ILE . 6.3 tt -64.26 -49.2 72.8 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.875 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 87' ' ' SER . 5.7 mt -60.67 -44.27 96.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.206 0.527 . . . . 0.0 110.018 179.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.52 -40.22 71.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.95 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.22 -53.7 34.01 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.083 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 67.2 mt -60.07 -38.17 82.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.736 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -54.2 48.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.909 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -56.42 -38.89 72.19 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.029 0.442 . . . . 0.0 110.314 179.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -51.78 62.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.886 179.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 3.2 mttm -60.69 -53.52 56.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.783 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -58.34 -25.36 61.86 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.682 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -69.1 -53.21 21.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.853 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 53.58 -176.38 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.078 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.86 -45.91 0.87 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.757 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.824 179.795 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.829 0.347 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 146.7 168.33 13.57 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.521 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.43 -176.1 1.55 Allowed 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.627 2.218 . . . . 0.0 112.361 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 164.48 -71.15 0.19 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.512 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -94.58 -20.02 19.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.67 0.271 . . . . 0.0 111.098 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.7 mt -54.05 -32.83 55.74 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.098 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.1 p -65.79 -47.84 84.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.251 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HG2' ' CE2' ' A' ' 80' ' ' TYR . 0.1 OUTLIER -59.42 -53.35 59.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.167 0.508 . . . . 0.0 110.519 179.726 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.407 HG11 ' CE ' ' A' ' 63' ' ' MET . 3.8 t -56.79 -39.04 61.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.058 179.132 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -63.75 -37.29 94.47 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.596 -0.811 . . . . 0.0 111.158 178.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.5 m -57.09 -44.85 83.57 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 178.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.75 -37.75 85.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.701 178.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.74 -40.33 69.2 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.82 -37.84 88.96 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.25 178.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.58 -34.31 77.54 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.861 179.066 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.447 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 9.4 mt -62.59 -50.26 71.98 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.958 179.275 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -57.81 -38.24 75.2 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.218 179.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.4 tptt -57.68 -44.56 85.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.295 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.447 ' CD2' ' HA ' ' A' ' 31' ' ' LEU . 4.7 m-85 -61.22 -39.86 91.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.083 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -56.36 -43.72 79.42 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.355 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -59.9 -54.47 45.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.505 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.8 t -56.42 -37.88 53.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.687 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.5 t -71.79 -37.68 63.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.816 179.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 t -58.01 -37.25 73.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.36 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.47 -20.45 60.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.035 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.2 mt -81.73 -28.42 33.38 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.953 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.5 -75.18 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.999 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -57.82 157.04 7.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.998 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 58.57 54.78 34.96 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.512 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.44 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -87.19 -49.68 0.46 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.578 0.228 . . . . 0.0 111.324 -179.737 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 52.5 Cg_exo -53.38 -41.88 69.64 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.556 2.17 . . . . 0.0 112.647 -179.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -56.62 -50.36 72.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.967 0.413 . . . . 0.0 110.888 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.567 ' O ' HG13 ' A' ' 52' ' ' ILE . 2.1 t -64.34 -56.13 17.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.613 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.448 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 49.0 m-80 -54.82 -25.44 28.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.07 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.16 -48.65 41.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.851 0.357 . . . . 0.0 111.5 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -77.19 -45.3 27.11 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-O 121.409 0.623 . . . . 0.0 109.815 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.567 HG13 ' O ' ' A' ' 48' ' ' VAL . 4.0 mt -57.77 -35.73 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.592 179.039 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.492 ' O ' HG12 ' A' ' 57' ' ' ILE . 2.9 tmtm? -69.88 -54.25 14.32 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.329 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.497 ' HA ' HG12 ' A' ' 57' ' ' ILE . 27.2 p30 -60.74 -30.77 70.2 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.524 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.44 ' N ' ' OD1' ' A' ' 54' ' ' ASN . 75.2 mt -72.02 -38.94 69.49 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.23 -31.13 68.77 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.497 HG12 ' HA ' ' A' ' 54' ' ' ASN . 4.8 mm -68.09 -43.64 85.1 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.294 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.691 178.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.1 t -58.56 -51.34 70.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.341 179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 57.3 mt -61.69 -53.4 48.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.658 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.43 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 0.4 OUTLIER -55.17 -32.7 62.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.293 179.434 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.14 -49.23 75.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.761 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.658 ' O ' HG12 ' A' ' 66' ' ' ILE . 0.9 OUTLIER -56.4 -57.3 12.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.069 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.43 ' CG ' ' HA ' ' A' ' 60' ' ' ASP . 0.0 OUTLIER -46.0 -53.38 10.17 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.241 0.338 . . . . 0.0 110.967 -179.882 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.92 -24.48 66.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.923 0.392 . . . . 0.0 110.863 179.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.0 mtpt -82.61 -29.21 30.3 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.196 0.522 . . . . 0.0 110.652 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.6 mm -73.02 -35.59 48.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.132 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.62 -26.34 15.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.578 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.446 ' O ' ' CG2' ' A' ' 69' ' ' THR . 1.1 m -106.44 22.11 16.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.703 0.287 . . . . 0.0 111.705 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.446 ' CG2' ' O ' ' A' ' 68' ' ' SER . 0.6 OUTLIER 177.74 155.86 0.35 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.836 179.568 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 9.2 mtp -82.59 72.48 9.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.818 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.4 mmm -68.71 134.13 49.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.96 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.59 138.84 33.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.731 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.18 -31.57 53.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.911 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.82 -43.34 98.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.641 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -68.08 -31.5 71.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.685 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.412 HG22 HD12 ' A' ' 76' ' ' ILE . 29.7 mm -71.82 -38.08 64.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.869 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -52.07 56.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.899 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.74 -48.85 79.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.721 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -56.35 -32.6 64.86 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 178.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.415 ' CE2' ' HG2' ' A' ' 23' ' ' LYS . 1.9 t80 -64.65 -35.9 82.53 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 177.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -69.57 -37.66 77.06 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.057 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.05 -36.08 76.52 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 121.186 0.517 . . . . 0.0 109.678 178.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.0 mt -76.2 -30.54 58.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.004 178.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 60.9 t -68.97 -35.84 71.09 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.457 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.01 -49.24 38.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.086 0.469 . . . . 0.0 110.322 179.52 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.1 p -65.01 -41.6 95.19 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.212 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.5 m -64.54 -50.17 68.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.587 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -51.97 -41.99 62.56 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.676 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.96 -30.64 68.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.723 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 tt -64.91 -48.98 72.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.42 HD23 ' CE1' ' A' ' 34' ' ' PHE . 6.9 mt -62.06 -49.57 75.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.068 0.461 . . . . 0.0 109.977 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.4 m -56.49 -30.7 63.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.72 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.456 ' HA ' ' HG2' ' A' ' 96' ' ' LYS . . . -69.88 -53.28 18.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.159 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.8 mt -61.87 -45.61 93.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.044 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -62.11 -44.93 95.58 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.207 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.456 ' HG2' ' HA ' ' A' ' 93' ' ' ALA . 1.3 pttm -61.68 -29.49 70.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.936 0.398 . . . . 0.0 110.184 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.9 mtmm -69.1 -58.19 4.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.109 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.32 -50.94 72.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.534 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -57.16 -39.96 76.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.158 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -59.76 -44.83 93.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.814 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 58.1 -177.45 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.925 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -132.17 7.77 4.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.503 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 C--N 1.331 -0.218 0 CA-C-O 120.711 0.291 . . . . 0.0 110.817 -179.977 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.834 0.349 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 147.3 -133.92 4.96 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.491 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -66.24 66.19 0.47 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.695 2.263 . . . . 0.0 112.282 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.16 -45.02 0.89 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.377 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.11 -27.85 14.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.744 0.307 . . . . 0.0 110.78 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 10.4 mt -55.88 -32.94 64.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.046 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.6 p -63.84 -45.75 96.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.013 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.1 mttt -60.3 -49.27 78.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.094 0.473 . . . . 0.0 110.48 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.403 ' CG1' ' CE ' ' A' ' 63' ' ' MET . 21.6 t -56.96 -43.48 80.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.403 179.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.02 -38.05 95.44 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.645 -0.788 . . . . 0.0 111.452 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.2 m -56.76 -45.63 81.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.084 0.468 . . . . 0.0 109.938 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.4 ' CD2' ' CD1' ' A' ' 83' ' ' LEU . 8.6 tp -61.91 -38.37 88.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.895 179.119 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -41.22 67.94 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 178.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -65.06 -37.93 89.18 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.471 178.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.02 -33.39 75.94 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.929 178.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.1 mt -62.17 -51.91 65.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.166 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -57.91 -36.78 72.93 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.211 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.1 tptt -58.61 -43.97 89.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.469 179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -62.72 -42.56 99.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.424 179.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -54.13 -45.64 71.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.838 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -55.27 32.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.895 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 31.5 t -55.94 -38.69 53.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.914 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.6 t -75.19 -33.81 29.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.75 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.0 t -61.2 -33.29 73.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.512 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.2 -29.95 67.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.779 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.55 79.92 1.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.797 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.45 -27.9 2.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.396 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -56.38 107.39 0.37 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.967 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 80.89 54.59 3.58 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.321 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.491 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -82.61 -45.97 0.92 Allowed Pre-proline 0 C--N 1.329 -0.301 0 N-CA-C 111.44 0.163 . . . . 0.0 111.44 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 52.7 Cg_exo -53.19 -43.75 54.61 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.296 1.998 . . . . 0.0 112.424 -179.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -58.37 -49.53 76.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.941 0.401 . . . . 0.0 110.622 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.409 ' O ' HG13 ' A' ' 52' ' ' ILE . 4.9 t -60.86 -54.93 28.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.74 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.404 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 21.2 m-80 -54.02 -25.73 22.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.032 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.83 -51.74 20.96 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.955 0.407 . . . . 0.0 111.52 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -73.26 -45.41 55.95 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.469 0.652 . . . . 0.0 109.276 179.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.4 mt -57.51 -31.95 40.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.312 178.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 25.6 tttt -69.32 -52.41 27.59 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.475 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.9 m-20 -51.14 -41.68 60.25 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.834 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.8 mp -68.86 -42.98 76.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.256 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.75 -36.6 69.95 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 178.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 11.8 mt -71.31 -42.43 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.329 178.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.1 m -59.73 -54.97 40.12 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.722 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 45.6 mt -58.5 -53.94 39.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.879 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.9 -34.39 67.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.578 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.58 -49.62 76.8 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.244 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.652 ' O ' HG12 ' A' ' 66' ' ' ILE . 2.1 mp -55.53 -54.73 40.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.463 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.404 ' CA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -44.86 -57.0 4.04 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.19 -179.839 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.06 -24.8 64.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.832 0.348 . . . . 0.0 110.599 179.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.7 mtpt -81.96 -29.76 32.02 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.624 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.652 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -71.88 -33.76 49.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.076 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 21.2 mmmt -93.82 -2.51 53.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.273 -179.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.407 ' C ' ' CG2' ' A' ' 69' ' ' THR . 13.0 m -140.17 19.87 2.43 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.407 ' CG2' ' C ' ' A' ' 68' ' ' SER . 0.4 OUTLIER -161.64 161.72 29.68 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.495 179.281 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -95.23 45.65 1.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.028 0.442 . . . . 0.0 110.58 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.84 130.43 29.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.215 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.6 m -80.08 142.38 34.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.747 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -30.52 59.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.74 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -47.25 86.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.434 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -64.31 -32.82 74.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.434 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 25.4 mm -70.59 -36.81 67.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.742 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -63.32 -52.21 62.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.77 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.8 tptt -62.18 -46.62 88.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.561 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -56.45 -33.31 65.77 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -64.35 -37.5 87.74 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.86 -36.54 75.6 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.977 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.45 -36.07 75.24 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.247 0.546 . . . . 0.0 109.794 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.4 ' CD1' ' CD2' ' A' ' 27' ' ' LEU . 2.7 mt -76.74 -31.18 56.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.032 179.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 47.7 t -69.83 -35.14 63.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.617 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -72.21 -49.46 35.22 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.447 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.4 m -66.03 -40.33 90.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.435 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.404 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 28.4 t -64.89 -50.06 68.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.607 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -52.84 -44.43 66.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.842 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -69.41 -27.68 65.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.82 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.405 ' CD1' HG12 ' A' ' 52' ' ' ILE . 7.3 tt -67.73 -49.22 63.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.067 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.9 mt -62.3 -49.11 76.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.175 0.512 . . . . 0.0 109.863 179.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.3 m -55.42 -37.65 67.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.46 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.4 -40.28 74.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.827 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.6 tp -62.64 -51.8 65.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -55.91 -50.53 70.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.618 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -58.81 -28.98 66.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.128 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.8 tttm -62.77 -52.17 64.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.611 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -53.37 58.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.774 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -25.53 63.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.705 179.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -70.16 -49.09 54.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.814 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 55.9 -179.39 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.904 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -60.48 -72.87 0.1 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.827 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.827 -179.992 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.892 0.377 . . . . 0.0 110.999 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 135.92 69.18 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.583 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -74.79 -32.07 6.04 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.56 2.173 . . . . 0.0 112.273 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.54 71.2 0.36 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.54 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.9 p -178.1 -40.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.795 0.331 . . . . 0.0 110.838 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.4 mp -64.38 -32.64 74.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.029 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 32.4 t -62.5 -52.78 55.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.291 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.2 tptt -54.17 -45.22 72.04 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.919 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.403 ' HB ' ' CE ' ' A' ' 63' ' ' MET . 11.5 t -56.73 -49.15 79.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.296 179.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.9 -40.07 98.37 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.554 -0.831 . . . . 0.0 111.559 178.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.757 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.1 OUTLIER -56.71 -42.32 78.97 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.253 0.549 . . . . 0.0 109.716 179.269 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.419 HD11 ' CG ' ' A' ' 80' ' ' TYR . 0.8 OUTLIER -59.91 -39.63 86.09 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.181 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -53.88 -35.02 61.14 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.757 ' HG3' ' HA ' ' A' ' 26' ' ' THR . 2.6 mmtt -60.17 -48.26 82.48 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.366 -0.833 . . . . 0.0 109.14 177.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.94 -33.86 62.66 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.402 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.422 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 1.4 mp -63.47 -49.74 72.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.244 179.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.67 -32.91 70.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.324 179.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 tppt? -61.91 -45.93 91.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.284 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.432 ' CZ ' ' HB2' ' A' ' 87' ' ' SER . 8.5 m-85 -60.09 -50.17 74.77 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.659 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -54.22 -38.6 65.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.918 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -51.71 68.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.014 0.435 . . . . 0.0 110.599 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 30.7 t -62.67 -37.85 80.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.736 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.9 t -63.07 -36.22 74.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.954 179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.5 m -75.83 -29.22 58.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.926 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.22 -29.21 38.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.376 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.6 pp -93.4 -35.94 12.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.999 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.3 mptt 58.41 102.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.97 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 174.9 122.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.729 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 58.14 68.09 1.87 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.477 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.468 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -69.5 -47.59 25.87 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 111.553 0.205 . . . . 0.0 111.553 -179.705 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.468 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 35.8 Cg_exo -60.52 -49.38 9.04 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.504 2.136 . . . . 0.0 113.07 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -58.21 -50.03 74.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.845 0.355 . . . . 0.0 111.649 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.623 ' O ' HG13 ' A' ' 52' ' ' ILE . 14.6 p -72.66 -46.55 53.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.343 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.472 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 98.9 m-20 -59.43 -39.0 82.14 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.992 -0.283 . . . . 0.0 111.528 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -71.48 -41.85 68.83 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -179.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -71.78 -46.87 56.94 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.623 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.1 mt -57.33 -30.0 34.43 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.059 178.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -69.07 -51.15 41.72 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.342 179.035 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 16.2 m-20 -51.5 -41.44 60.99 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.601 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 26.3 mt -67.41 -43.83 80.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.219 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -37.56 71.17 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.515 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 9.7 mt -71.26 -40.76 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.134 178.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 39.9 t -57.83 -53.01 63.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.477 179.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.4 mt -60.39 -52.98 55.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.568 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.77 -33.67 68.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.465 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.84 -49.36 78.01 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.271 179.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.672 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.2 mp -55.42 -55.1 35.6 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.703 179.448 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.403 ' CE ' ' HB ' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -44.93 -58.54 3.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.164 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.49 -23.8 63.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.683 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -82.48 -29.79 30.34 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.545 179.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.672 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.9 mm -71.63 -35.78 57.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.236 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.7 mmmt -96.07 1.41 52.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.347 -179.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.402 ' C ' ' CG2' ' A' ' 69' ' ' THR . 19.5 m -141.93 23.33 2.07 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.402 ' CG2' ' C ' ' A' ' 68' ' ' SER . 0.7 OUTLIER -160.39 174.03 14.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.924 0.392 . . . . 0.0 110.756 179.239 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.17 38.2 2.27 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.643 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.0 mmm -55.52 141.3 37.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.059 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.3 m -84.9 145.25 27.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.754 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.4 -31.46 61.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.755 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.11 -37.9 84.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.394 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -68.59 -32.57 72.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.515 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 25.6 mm -72.51 -34.48 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.717 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.02 -50.72 61.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.66 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.9 -46.3 88.47 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.5 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -56.45 -34.22 66.64 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.419 ' CG ' HD11 ' A' ' 27' ' ' LEU . 3.3 t80 -64.15 -37.06 86.11 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 177.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.43 -36.89 77.1 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.938 178.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.59 -36.33 76.06 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.126 0.488 . . . . 0.0 109.687 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.7 mt -76.43 -32.42 58.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.917 178.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 58.9 t -67.95 -34.3 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.428 179.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -48.81 39.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.357 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.14 -38.51 91.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.574 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.432 ' HB2' ' CZ ' ' A' ' 34' ' ' PHE . 25.6 p -66.13 -46.49 77.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.596 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.81 -44.21 73.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.972 0.415 . . . . 0.0 110.559 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -67.93 -30.57 69.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.681 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.402 HD22 ' CG ' ' A' ' 34' ' ' PHE . 7.6 tt -62.77 -47.75 82.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.739 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.8 mt -62.41 -49.19 76.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.124 0.488 . . . . 0.0 109.708 179.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 24.1 m -57.1 -40.34 76.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.473 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.73 -51.71 46.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.712 179.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.2 mp -53.48 -51.6 62.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.794 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -55.67 -40.27 72.06 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.089 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.05 -53.28 60.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.61 179.351 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.4 mttt -54.67 -36.54 64.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.196 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.98 -53.93 42.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.987 0.422 . . . . 0.0 110.656 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -62.71 -25.3 68.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.572 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -77.38 -52.84 8.48 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.134 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -127.62 150.91 49.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.007 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -97.38 -38.5 9.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.923 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.035 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.88 0.371 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -159.81 -95.43 0.11 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.479 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.88 158.48 6.35 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.548 2.165 . . . . 0.0 112.321 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.95 -41.64 2.13 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.502 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -100.53 -30.51 11.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.857 0.361 . . . . 0.0 110.911 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.1 mt -66.13 -32.89 74.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.014 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.1 p -60.63 -49.42 84.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.358 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -46.4 83.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.852 0.358 . . . . 0.0 110.648 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.4 t -56.84 -40.68 72.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.203 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.14 -41.98 96.72 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.646 -0.787 . . . . 0.0 111.424 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.616 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -57.97 -33.26 68.68 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.133 0.492 . . . . 0.0 109.998 179.2 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.421 HD11 ' CE1' ' A' ' 80' ' ' TYR . 13.6 tp -67.98 -45.49 73.98 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.0 mttm -52.8 -33.67 50.04 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.616 ' HG3' ' HA ' ' A' ' 26' ' ' THR . 15.7 mttt -63.52 -47.27 82.35 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.831 178.321 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.435 ' HG2' ' CZ ' ' A' ' 34' ' ' PHE . 63.1 ttt180 -61.34 -32.28 72.16 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.409 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.2 mp -62.47 -50.6 70.81 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.268 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -58.03 -37.64 74.74 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.12 0.486 . . . . 0.0 109.915 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.7 tptt -57.75 -42.83 84.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.061 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.435 ' CZ ' ' HG2' ' A' ' 30' ' ' ARG . 18.9 m-30 -62.5 -42.46 99.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.254 179.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -53.19 -46.14 68.88 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.649 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -59.98 -54.32 47.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.505 179.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.8 t -56.05 -37.86 50.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.559 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.5 t -74.09 -33.53 35.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.583 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.3 t -61.76 -32.93 73.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.313 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.28 -27.44 56.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.212 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 18.7 mt -59.78 -45.76 91.29 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.929 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 63.61 14.7 8.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.487 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -133.55 134.14 42.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.849 0.357 . . . . 0.0 110.9 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 59.0 69.81 1.17 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.487 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.528 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 2.0 mmpm? -82.93 -42.99 0.88 Allowed Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.1 Cg_exo -53.6 -49.0 18.85 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.301 2.0 . . . . 0.0 112.374 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.422 ' HA ' ' NH1' ' A' ' 50' ' ' ARG . 0.9 OUTLIER -55.6 -46.93 77.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.011 0.434 . . . . 0.0 111.076 179.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.61 ' O ' HG13 ' A' ' 52' ' ' ILE . 11.8 t -65.83 -55.69 18.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.136 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -53.43 -34.9 59.59 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -179.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.445 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 5.3 ptp85 -74.37 -35.23 63.53 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -179.365 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.445 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 26.2 mt-30 -80.71 -47.56 13.81 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.554 0.692 . . . . 0.0 109.531 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 48' ' ' VAL . 2.6 mt -60.23 -33.67 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.101 178.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.404 ' O ' HG13 ' A' ' 57' ' ' ILE . 0.2 OUTLIER -70.03 -54.13 14.53 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.265 179.776 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.413 ' ND2' ' HA ' ' A' ' 51' ' ' GLN . 26.8 p30 -59.01 -25.48 63.69 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.738 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 84.6 mt -79.27 -44.44 21.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.356 . . . . 0.0 110.102 178.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.71 -35.67 68.8 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.407 ' CD1' ' HA ' ' A' ' 54' ' ' ASN . 12.0 mt -70.54 -41.88 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.127 178.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 24.2 m -58.69 -55.14 38.91 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.472 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.0 mt -60.61 -52.51 60.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.63 179.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -58.48 -34.1 70.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.505 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.33 -49.63 76.51 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.024 0.44 . . . . 0.0 110.023 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.666 ' O ' HG12 ' A' ' 66' ' ' ILE . 0.7 OUTLIER -55.61 -52.81 62.52 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.277 178.967 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.4 ' CA ' HG12 ' A' ' 66' ' ' ILE . 17.7 tpp -45.02 -57.92 3.52 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.211 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.9 -24.2 64.1 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.619 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -81.97 -29.78 31.98 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.539 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.666 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.8 mm -71.63 -36.38 59.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.095 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt -96.18 1.23 52.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.945 -0.571 . . . . 0.0 112.265 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.406 ' C ' ' CG2' ' A' ' 69' ' ' THR . 3.0 t -138.46 20.49 2.74 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.406 ' CG2' ' C ' ' A' ' 68' ' ' SER . 0.7 OUTLIER -160.84 177.08 10.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.888 0.375 . . . . 0.0 110.649 179.405 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.3 ttt -109.21 41.39 1.64 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.536 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 15.3 mmm -55.49 145.02 23.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.138 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.48 146.65 23.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.797 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 86.4 mtm-85 -54.75 -31.37 58.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.797 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.8 -39.0 87.26 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.414 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -67.47 -34.3 76.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.433 179.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 26.1 mm -72.09 -34.0 48.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.721 179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -66.68 -46.34 75.95 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.801 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 4.8 mmmt -66.54 -47.54 72.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.694 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.66 -34.18 67.09 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.421 ' CE1' HD11 ' A' ' 27' ' ' LEU . 88.3 t80 -64.96 -36.67 85.13 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.77 -37.79 76.52 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.936 178.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.98 -32.26 71.82 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.111 0.481 . . . . 0.0 109.758 178.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.4 ' CD1' ' CD2' ' A' ' 27' ' ' LEU . 5.0 mt -78.31 -30.62 48.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.021 178.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 60.2 t -68.97 -37.05 76.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.368 179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -49.15 35.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.452 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.7 p -64.47 -45.28 88.05 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.727 179.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 89.4 p -60.21 -49.28 78.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.56 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -54.5 -39.52 67.64 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.764 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -68.12 -31.63 71.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.753 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.8 tt -66.05 -46.46 77.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.997 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.433 HD23 ' CE1' ' A' ' 34' ' ' PHE . 6.5 mt -65.14 -48.52 73.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.169 0.509 . . . . 0.0 109.809 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.3 m -57.07 -32.68 66.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.539 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.416 ' O ' ' CG ' ' A' ' 96' ' ' LYS . . . -70.07 -53.11 18.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.777 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 14.4 mt -58.87 -42.2 88.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.672 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.97 -49.71 75.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.036 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.424 ' HA ' ' HG2' ' A' ' 99' ' ' GLN . 27.3 pttt -61.61 -28.65 69.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.939 0.399 . . . . 0.0 110.46 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mttm -70.8 -50.47 35.26 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.692 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -45.8 64.13 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 121.102 -0.239 . . . . 0.0 111.503 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.424 ' HG2' ' HA ' ' A' ' 96' ' ' LYS . 19.9 pt20 -59.63 -46.66 88.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.696 0.284 . . . . 0.0 111.263 -179.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -64.22 -39.83 94.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.828 0.347 . . . . 0.0 110.88 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.28 -30.08 70.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.805 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -86.31 -78.12 0.29 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.865 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.833 -179.918 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.724 0.297 . . . . 0.0 110.797 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -113.17 92.39 0.62 Allowed Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.573 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -54.88 90.3 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.54 2.16 . . . . 0.0 112.274 179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -134.85 41.91 1.4 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.525 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 m -164.32 -43.76 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.766 0.317 . . . . 0.0 110.83 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.6 mt -57.06 -35.97 69.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.072 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.8 p -69.34 -46.69 76.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.191 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -60.15 -46.52 89.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.168 0.509 . . . . 0.0 110.506 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.449 HG11 ' CG2' ' A' ' 59' ' ' ILE . 14.4 t -56.83 -45.97 83.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.632 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.76 -38.77 95.75 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.55 -0.833 . . . . 0.0 111.704 179.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -56.89 -43.85 81.74 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.057 0.456 . . . . 0.0 110.153 179.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.416 HD12 ' CD2' ' A' ' 80' ' ' TYR . 0.7 OUTLIER -61.63 -42.02 98.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.054 179.254 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.88 -40.07 63.19 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 178.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.53 -38.64 91.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.63 178.44 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -63.48 -36.56 84.16 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.922 179.12 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.9 mp -62.03 -43.52 98.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.254 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.28 -47.42 85.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.843 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.442 ' HG3' ' N ' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -60.06 -33.64 72.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.006 -179.991 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.452 ' CE1' ' CD2' ' A' ' 91' ' ' LEU . 10.8 m-85 -65.59 -43.91 88.25 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.512 179.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -60.77 -39.3 88.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.476 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -59.15 -54.69 44.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.478 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 24.0 t -58.8 -37.9 69.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.781 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.0 t -70.74 -31.45 45.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.061 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.3 m -73.82 -27.1 60.94 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.98 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.45 -34.86 65.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.413 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.1 pp -87.79 -25.98 23.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.284 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 4.7 mptt 58.55 179.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.974 0.416 . . . . 0.0 111.114 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.5 t70 70.13 149.12 0.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.749 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.47 24.76 66.2 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.375 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.454 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -54.3 -48.93 93.12 Favored Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 111.516 0.191 . . . . 0.0 111.516 -179.836 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 50.5 Cg_exo -53.79 -46.84 30.73 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.292 1.995 . . . . 0.0 112.581 -179.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -63.12 -50.44 70.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.412 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.463 ' O ' HG13 ' A' ' 52' ' ' ILE . 11.9 t -65.11 -55.78 18.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.148 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.61 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 73.6 m-20 -54.07 -28.42 38.82 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.224 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.4 -49.54 33.07 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.406 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 28.4 mt-30 -74.15 -43.5 57.2 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.532 0.682 . . . . 0.0 109.588 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.2 mt -57.15 -36.2 50.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.376 179.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.61 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -69.08 -46.02 68.84 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.187 178.835 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.7 m-20 -51.19 -41.34 60.15 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.732 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 51' ' ' GLN . 5.3 mt -69.25 -43.3 74.25 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 120.722 0.296 . . . . 0.0 110.351 179.33 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -36.43 69.31 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 10.9 mt -70.96 -42.25 77.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 115.096 -0.957 . . . . 0.0 110.171 178.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.5 m -59.49 -46.12 89.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.419 179.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.449 ' CG2' HG11 ' A' ' 24' ' ' VAL . 46.3 mt -63.97 -53.49 43.37 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.527 179.443 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.429 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 96.0 m-20 -57.26 -34.19 68.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.301 179.437 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.88 -49.1 78.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.783 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.657 ' O ' HG12 ' A' ' 66' ' ' ILE . 0.8 OUTLIER -55.78 -56.49 19.93 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.998 179.929 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.443 ' H ' ' HG2' ' A' ' 63' ' ' MET . 0.0 OUTLIER -45.6 -53.78 8.62 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 123.198 0.311 . . . . 0.0 110.792 -179.92 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.07 -25.19 66.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.927 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 mtmp? -82.35 -30.42 30.38 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.137 0.494 . . . . 0.0 110.596 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -71.22 -33.81 52.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.99 -179.495 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.81 0.95 57.51 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.214 -179.302 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 m -142.88 22.12 1.94 Allowed 'General case' 0 C--O 1.233 0.192 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -160.34 157.4 27.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.605 179.206 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.63 36.49 1.77 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.49 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.7 138.71 55.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.071 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.9 m -74.32 145.71 43.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.806 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.26 -30.61 62.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.668 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -59.37 -45.1 92.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.427 179.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -60.24 -33.58 72.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.376 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 19.1 mm -70.88 -34.07 54.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.497 179.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -50.88 68.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.609 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.8 mmtm -61.14 -46.34 90.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.47 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -56.52 -33.47 66.08 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.416 ' CD2' HD12 ' A' ' 27' ' ' LEU . 2.5 t80 -63.81 -38.08 89.78 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 177.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.6 -36.36 76.14 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.144 178.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.97 -37.36 76.6 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.253 0.549 . . . . 0.0 109.921 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 24.8 mt -76.48 -30.08 57.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.112 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 49.0 t -71.11 -34.66 55.74 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.543 179.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -72.02 -49.28 38.27 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.436 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.5 m -62.95 -40.81 98.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.28 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 m -62.93 -50.07 72.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.513 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -52.38 -41.75 63.39 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.021 0.439 . . . . 0.0 110.747 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -67.5 -32.74 73.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.688 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.1 tt -64.98 -47.08 78.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.964 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.452 ' CD2' ' CE1' ' A' ' 34' ' ' PHE . 6.7 mt -60.88 -48.79 80.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.238 0.542 . . . . 0.0 109.982 179.63 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.04 -42.69 72.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.334 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.91 -36.83 84.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.316 179.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.9 mt -66.91 -42.68 85.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.427 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.497 ' HA ' ' HD2' ' A' ' 98' ' ' LYS . 0.6 OUTLIER -55.95 -54.19 47.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.325 179.635 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.77 -28.74 69.66 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.261 179.187 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.3 tttm -66.63 -43.33 84.98 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.156 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.497 ' HD2' ' HA ' ' A' ' 95' ' ' GLN . 14.2 mttt -66.01 -53.66 35.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.223 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -25.53 67.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.719 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -72.01 -53.33 13.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.903 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -144.88 145.39 31.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.882 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.94 -45.06 0.52 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.152 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.943 -179.966 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 . . . . . 0 C--O 1.233 0.208 0 CA-C-O 120.779 0.323 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 112.3 -144.63 17.85 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.559 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.01 -170.75 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.57 2.18 . . . . 0.0 112.389 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 83.77 142.89 5.27 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.359 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.4 m 75.15 -58.05 0.58 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.672 0.272 . . . . 0.0 111.034 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -53.67 -32.76 52.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.085 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.0 p -57.74 -48.35 83.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.303 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 22.0 mttt -64.48 -41.92 96.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.888 0.375 . . . . 0.0 110.421 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 25.5 t -57.48 -48.49 82.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.703 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -59.35 -41.22 96.83 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.624 -0.798 . . . . 0.0 111.801 179.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.69 -36.3 74.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.905 0.383 . . . . 0.0 110.263 179.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.416 HD11 ' CE2' ' A' ' 80' ' ' TYR . 0.4 OUTLIER -64.59 -47.01 80.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.752 179.336 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.4 tttm -53.18 -36.37 60.86 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -68.72 -35.11 76.72 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.451 178.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -34.48 77.86 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.893 178.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.2 mp -63.71 -50.36 69.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.128 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -58.02 -35.76 71.73 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.19 179.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.9 tptt -60.4 -46.13 91.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.348 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -59.59 -42.7 93.14 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.49 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -58.28 -40.77 82.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.474 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -59.47 -49.74 76.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.508 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.4 t -63.2 -37.9 80.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.505 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.2 t -68.23 -38.26 79.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.787 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.3 m -67.58 -30.72 70.41 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.738 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.57 -29.74 69.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.276 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.2 pp -100.99 -22.52 14.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.208 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 63.08 -173.82 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.912 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 62.24 155.46 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.758 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 63.7 33.16 86.51 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.319 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.554 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 16.8 mmtp -62.97 -55.29 38.98 Favored Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 10.0 Cg_endo -53.55 -43.03 61.13 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.561 2.174 . . . . 0.0 112.856 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -66.5 -41.02 89.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.786 0.327 . . . . 0.0 111.185 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.516 ' O ' HG13 ' A' ' 52' ' ' ILE . 47.4 t -71.19 -56.24 11.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.45 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 21.1 p30 -59.26 -25.46 64.08 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.946 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 11.1 ttt-85 -72.92 -47.14 48.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.778 0.323 . . . . 0.0 111.386 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -76.64 -46.05 27.46 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.421 0.629 . . . . 0.0 109.598 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.8 mt -57.39 -34.09 45.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.372 179.109 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 4.9 tptt -69.41 -52.36 27.69 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.534 179.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.426 ' HA ' HD12 ' A' ' 57' ' ' ILE . 15.2 m-20 -51.52 -34.16 34.94 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.539 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.9 mt -76.63 -43.26 39.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.392 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.71 -35.0 68.01 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.435 HD12 ' HG3' ' A' ' 53' ' ' LYS . 14.0 mt -70.49 -43.49 77.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.187 178.728 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.7 t -57.91 -45.92 85.77 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.681 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 13.9 mt -59.94 -54.47 34.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.757 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -57.54 -33.52 68.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.622 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.81 -49.55 77.27 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.474 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.664 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.5 mp -55.73 -55.03 37.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.695 179.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 9.3 tpp -45.12 -55.57 5.56 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.267 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.89 -24.24 66.82 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.805 0.336 . . . . 0.0 110.546 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.408 ' O ' ' OG1' ' A' ' 69' ' ' THR . 4.6 mtmm -82.25 -28.91 31.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.473 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.664 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.1 mm -71.88 -40.65 68.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.336 -179.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -92.56 -29.05 16.38 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.773 -179.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.417 ' O ' ' CG2' ' A' ' 69' ' ' THR . 1.2 t -103.14 24.41 10.89 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.714 0.264 . . . . 0.0 111.714 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.417 ' CG2' ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 177.53 150.14 0.18 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.156 179.623 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 11.0 ttp -75.17 64.37 1.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.872 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.63 124.49 21.12 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.779 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.8 m -77.11 136.38 38.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.771 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.3 mtm180 -52.77 -35.29 56.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.911 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -59.94 -42.34 93.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.458 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -67.22 -32.59 73.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.515 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 27.1 mm -70.11 -37.13 71.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.828 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -65.1 -50.36 66.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.692 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -63.57 -46.9 83.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.675 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -56.46 -34.0 66.45 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.416 ' CE2' HD11 ' A' ' 27' ' ' LEU . 3.5 t80 -64.15 -37.36 87.16 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -69.72 -36.8 76.2 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.17 178.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.74 -39.89 78.41 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.249 0.547 . . . . 0.0 109.681 179.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mt -74.34 -30.19 61.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.062 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 57.3 t -70.2 -36.2 66.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.413 179.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.71 -49.43 58.97 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.204 179.467 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 58.5 m -63.95 -43.6 95.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.982 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.42 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 67.3 m -60.98 -50.0 75.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.338 179.329 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -50.3 -43.66 53.76 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.637 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -37.28 86.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.464 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.98 -44.14 96.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.929 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.5 mt -62.63 -48.67 78.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.08 0.466 . . . . 0.0 109.918 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.2 t -57.2 -43.58 82.85 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.645 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.07 -46.17 82.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.797 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.4 tp -61.67 -44.97 95.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.827 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.83 -44.86 78.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.775 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -58.4 -48.92 79.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.524 179.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt -55.14 -39.33 69.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.217 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 3.8 mttt -65.02 -54.04 36.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.047 0.451 . . . . 0.0 110.882 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -62.0 -25.46 67.65 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.515 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.81 -47.24 54.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.931 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 58.06 171.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.854 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -111.51 -28.35 8.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.049 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.992 -179.796 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.881 0.372 . . . . 0.0 110.785 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -73.44 130.27 13.22 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.386 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.53 86.91 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.464 2.109 . . . . 0.0 112.272 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.36 56.66 0.59 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.391 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 m -165.91 -41.7 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.806 0.336 . . . . 0.0 110.971 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 17.7 mt -53.85 -32.86 54.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.109 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.9 p -63.99 -46.78 93.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.1 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.71 -46.76 77.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.06 0.457 . . . . 0.0 110.614 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.3 t -57.0 -44.39 82.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.357 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.4 -38.24 95.41 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.646 -0.788 . . . . 0.0 111.574 179.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.7 -42.92 84.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.973 0.416 . . . . 0.0 110.102 179.232 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.404 ' CD1' ' CD1' ' A' ' 31' ' ' LEU . 1.5 tm? -61.59 -43.73 98.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.105 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.86 -39.54 62.65 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 178.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.83 -36.83 85.59 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.579 178.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.06 -33.1 75.23 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.901 178.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.422 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 2.2 mp -62.74 -52.54 62.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.284 179.331 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.77 -36.1 71.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.329 179.463 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -59.63 -44.67 93.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.411 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.422 ' CD2' ' HA ' ' A' ' 31' ' ' LEU . 11.5 m-85 -60.93 -43.22 98.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.509 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -54.24 -46.7 72.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.793 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -58.73 -51.39 70.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.891 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.7 t -61.32 -40.24 85.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.992 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 56.2 t -68.0 -39.76 82.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.93 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.5 t -69.12 -25.19 64.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.929 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.21 -32.21 64.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.391 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.7 pp -96.39 -21.64 17.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.34 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.62 -174.97 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.039 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.4 t70 70.82 139.14 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.855 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 60.71 60.35 8.62 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.269 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.485 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 13.9 mmtp -83.68 -46.01 0.79 Allowed Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 111.398 0.147 . . . . 0.0 111.398 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.485 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.9 Cg_exo -53.29 -41.32 73.46 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.322 2.015 . . . . 0.0 112.446 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -67.8 -39.51 83.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.922 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.571 ' O ' HG13 ' A' ' 52' ' ' ILE . 33.6 t -70.82 -56.36 11.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.324 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.419 ' O ' ' CG ' ' A' ' 53' ' ' LYS . 15.4 p30 -60.28 -25.33 65.65 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.018 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.418 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 7.4 tpp180 -73.55 -43.57 59.58 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.761 0.315 . . . . 0.0 111.405 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.42 ' HA ' ' ND2' ' A' ' 54' ' ' ASN . 3.2 mt-30 -81.31 -44.71 17.26 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.367 0.603 . . . . 0.0 110.0 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 48' ' ' VAL . 2.3 mt -58.09 -40.99 79.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.63 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.419 ' CG ' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -70.5 -50.8 34.04 Favored 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.42 ' ND2' ' HA ' ' A' ' 51' ' ' GLN . 30.2 p30 -59.68 -25.42 64.73 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.086 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 50.7 mt -80.02 -43.95 21.01 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.097 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -34.75 67.87 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 53' ' ' LYS . 13.3 mt -71.1 -43.5 75.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.1 178.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.53 -47.35 84.46 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.334 179.422 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.9 mt -58.44 -53.04 52.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.717 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -59.4 -33.85 71.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.624 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.62 -50.43 73.18 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.978 0.418 . . . . 0.0 110.316 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.661 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.0 OUTLIER -56.32 -54.93 39.6 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.306 179.071 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.89 -57.48 3.75 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.191 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.45 -24.87 63.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.957 0.408 . . . . 0.0 110.701 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 24.0 mtpt -82.27 -29.59 31.14 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.577 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.661 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -72.79 -35.33 49.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.202 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.01 1.26 57.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.16 -179.101 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.4 m -136.22 21.09 3.2 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.945 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.4 p -160.05 -168.35 2.19 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.949 0.404 . . . . 0.0 110.626 179.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 5.0 tpt -130.92 37.21 3.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.459 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 33.3 mtp -56.61 139.63 49.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.01 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.8 m -74.53 144.08 44.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.715 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.9 mtt180 -55.04 -30.41 59.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.584 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.88 -44.16 86.5 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.249 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -36.29 79.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.021 179.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.469 HD11 HG21 ' A' ' 76' ' ' ILE . 23.0 mm -71.19 -34.06 53.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.368 179.31 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -52.01 67.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.443 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 mppp? -61.91 -46.4 89.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.33 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -56.43 -33.78 66.17 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 12.0 t80 -63.54 -37.47 87.44 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -69.59 -36.2 76.03 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.801 178.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.56 -35.6 74.56 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-O 121.136 0.493 . . . . 0.0 109.728 178.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mt -77.13 -31.58 55.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.062 178.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 41.4 t -71.34 -35.03 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.571 179.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.99 -47.32 52.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.598 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.5 m -69.88 -36.86 75.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.709 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.1 m -65.08 -50.46 66.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.697 179.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -39.35 82.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.647 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -65.83 -31.17 71.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.561 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.2 tt -66.67 -48.19 70.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.697 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 5.8 mt -64.99 -46.64 80.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.168 0.508 . . . . 0.0 109.89 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.87 -35.43 70.95 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.636 179.553 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.43 -37.61 77.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.669 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.7 mt -71.42 -43.34 66.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.624 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -54.11 48.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.773 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.3 -34.92 77.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.138 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -62.42 -36.6 82.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.525 179.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.46 -53.58 33.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.399 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -57.85 -25.58 60.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.63 179.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -74.82 -43.87 52.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.762 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 61.41 31.56 19.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.952 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -138.03 173.65 11.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.867 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.804 179.921 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.805 0.336 . . . . 0.0 110.949 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 163.6 -105.52 0.25 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.465 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.44 -168.04 0.41 Allowed 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.538 2.159 . . . . 0.0 112.248 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.7 -73.87 0.64 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.713 -0.755 . . . . 0.0 112.546 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.3 p -60.17 -29.22 68.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.817 0.342 . . . . 0.0 111.028 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 10.9 mt -58.94 -32.77 69.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.006 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.7 t -61.71 -52.28 62.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.041 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -53.0 -41.24 64.46 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.999 0.428 . . . . 0.0 110.745 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.406 ' CG1' ' CG2' ' A' ' 59' ' ' ILE . 51.4 t -60.78 -49.73 83.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.332 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.19 -37.54 93.09 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.703 -0.76 . . . . 0.0 111.837 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.01 -46.86 82.02 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.912 0.387 . . . . 0.0 110.26 179.487 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 22.8 tp -62.01 -37.26 84.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.277 -0.419 . . . . 0.0 109.9 179.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.68 -38.89 70.23 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -38.65 88.29 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.672 178.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 20.1 mmt180 -59.8 -38.59 82.35 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.136 -0.483 . . . . 0.0 109.975 179.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.9 mt -62.5 -48.7 78.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.048 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.02 -38.06 75.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.087 179.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.2 tptt -58.9 -42.23 89.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.018 179.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -61.13 -43.95 98.09 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.25 179.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -54.56 -43.31 71.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.555 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.79 -52.61 64.99 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.393 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 24.0 t -59.31 -37.81 71.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.582 179.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 41.0 t -70.07 -31.2 46.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.895 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.42 -27.64 61.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.593 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.35 -34.4 76.03 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.205 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.8 pp -92.07 -20.19 21.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.245 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.19 -173.55 0.1 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.866 0.365 . . . . 0.0 110.898 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 64.57 151.56 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.805 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 59.8 29.17 66.9 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.306 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.525 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 0.4 OUTLIER -56.2 -57.55 21.91 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 120.494 0.188 . . . . 0.0 111.252 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 11.3 Cg_endo -54.96 -33.88 84.39 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.436 2.09 . . . . 0.0 112.228 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -67.07 -49.06 66.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.705 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.511 ' O ' HG13 ' A' ' 52' ' ' ILE . 25.8 t -69.93 -55.17 15.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.95 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.582 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 65.3 m-20 -52.85 -32.87 46.92 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.684 0.278 . . . . 0.0 111.106 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.6 ttt85 -72.15 -46.21 57.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.869 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.403 ' HG2' ' HA ' ' A' ' 48' ' ' VAL . 9.3 pt20 -73.04 -45.59 56.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.657 0.741 . . . . 0.0 109.472 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.511 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.7 mt -57.56 -32.89 43.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.314 178.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.582 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 7.1 tmtm? -69.16 -49.8 53.49 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.343 178.834 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.406 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 16.9 m-20 -50.98 -39.84 56.43 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.578 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.427 ' CD2' ' N ' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -71.17 -43.01 68.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.182 179.345 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -57.01 -36.79 70.84 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 178.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 53' ' ' LYS . 12.2 mt -69.63 -42.1 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.173 178.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.7 t -57.62 -51.52 69.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.192 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.406 ' CG2' ' CG1' ' A' ' 24' ' ' VAL . 5.9 mt -57.92 -46.49 87.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.281 179.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.8 -35.24 75.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.351 179.446 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.92 -49.81 75.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.283 179.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.658 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.6 mp -55.53 -54.0 49.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.439 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.15 -54.3 7.02 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.291 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.95 -25.22 67.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.863 0.363 . . . . 0.0 110.685 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 25.0 mtpt -82.04 -28.66 32.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.565 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.7 mm -73.06 -38.06 54.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.43 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.15 -27.57 16.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.715 -179.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.447 ' O ' ' CG2' ' A' ' 69' ' ' THR . 1.4 m -105.88 25.33 11.03 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.447 ' CG2' ' O ' ' A' ' 68' ' ' SER . 0.3 OUTLIER 174.14 155.12 0.12 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.878 179.678 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.6 mmt -83.23 82.44 8.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.946 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -84.18 119.03 24.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.054 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.7 m -73.43 144.34 46.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.607 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -52.65 -34.07 49.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.948 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -58.25 -49.09 78.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.47 179.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.32 -34.35 72.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.179 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.482 HD13 HG23 ' A' ' 76' ' ' ILE . 21.9 mm -72.4 -34.19 47.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.574 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -60.54 -48.58 81.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.519 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.71 -45.74 85.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.35 179.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.91 -35.99 69.65 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 178.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.463 ' CE2' ' CG2' ' A' ' 76' ' ' ILE . 9.5 m-85 -63.59 -35.08 79.31 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -68.92 -36.76 78.36 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.831 178.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.09 -35.16 76.25 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.261 0.553 . . . . 0.0 109.573 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.9 mt -76.56 -31.96 57.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.035 178.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 49.3 t -69.15 -34.16 62.02 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.362 179.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.9 mmpt? -72.03 -49.12 39.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.426 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 m -68.27 -37.52 80.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.609 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 98.7 p -67.06 -49.08 66.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.663 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -55.88 -43.96 77.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.975 0.417 . . . . 0.0 110.779 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -67.29 -30.67 70.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.729 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.1 tt -63.17 -47.63 81.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.018 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.4 mt -63.54 -47.2 82.57 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.215 0.531 . . . . 0.0 109.84 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 49.4 m -58.31 -42.93 87.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.505 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.77 -33.49 75.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.566 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.9 tp -67.59 -49.18 64.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.669 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.403 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 2.5 mp0 -55.75 -47.0 77.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.597 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.1 pttp -65.34 -28.74 69.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.03 0.443 . . . . 0.0 109.825 178.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -70.41 -53.93 14.47 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.177 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 0.0 OUTLIER -64.07 -41.23 97.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.846 0.355 . . . . 0.0 110.929 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -64.69 -33.69 76.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.672 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -78.09 -28.83 48.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.132 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -52.81 102.15 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.098 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -119.87 -27.42 5.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.277 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.176 -179.83 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.88 0.371 . . . . 0.0 110.796 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -72.12 -170.06 13.58 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.601 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -55.73 -61.85 0.32 Allowed 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.661 2.241 . . . . 0.0 112.295 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.58 -78.97 1.79 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.602 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.9 p -105.49 -26.39 11.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.74 0.305 . . . . 0.0 110.993 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.5 mt -55.11 -32.5 62.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.165 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 10.5 p -51.78 -46.99 40.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.36 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.69 -43.83 95.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.14 0.495 . . . . 0.0 110.371 179.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.1 t -57.61 -44.47 85.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.492 179.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.16 -38.57 96.38 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.716 179.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.82 -46.06 81.88 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.079 0.466 . . . . 0.0 110.096 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.425 HD11 ' CZ ' ' A' ' 80' ' ' TYR . 9.5 tp -62.12 -37.19 84.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.883 178.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.56 -38.77 69.76 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.671 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -38.01 84.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.706 178.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -61.22 -37.17 82.07 Favored 'General case' 0 N--CA 1.458 -0.068 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.178 179.336 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.413 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 2.6 mm? -63.91 -52.19 61.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.174 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.04 -32.43 67.97 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.303 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.6 tptt -63.07 -45.13 93.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.326 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.413 ' CD2' ' HA ' ' A' ' 31' ' ' LEU . 13.3 m-85 -60.4 -43.4 96.7 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.59 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -57.33 -42.64 82.31 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.726 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.01 -52.45 65.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.715 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 21.7 t -60.95 -37.95 78.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.871 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 56.1 t -70.09 -32.77 52.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.037 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -72.68 -29.32 63.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.861 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.05 -28.73 64.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.21 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 pp -101.49 -24.25 14.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.202 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.49 -169.7 0.15 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.816 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 64.51 136.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.76 -179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.2 26.16 72.84 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.327 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.556 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 1.9 mmtt -56.53 -55.72 39.73 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.52 0.2 . . . . 0.0 111.354 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.556 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 9.8 Cg_endo -53.49 -44.15 51.48 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.348 2.032 . . . . 0.0 112.275 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.88 -49.45 77.41 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.034 0.445 . . . . 0.0 110.511 179.664 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.446 ' O ' HG13 ' A' ' 52' ' ' ILE . 17.8 t -60.9 -55.28 25.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.756 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.401 ' O ' ' CB ' ' A' ' 53' ' ' LYS . 42.5 m-20 -54.83 -25.61 29.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.115 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -50.41 28.63 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.843 0.354 . . . . 0.0 111.555 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -74.89 -45.17 44.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.496 0.665 . . . . 0.0 109.398 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.5 mt -57.81 -32.35 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.276 178.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.401 ' CB ' ' O ' ' A' ' 49' ' ' ASN . 26.9 tttt -69.35 -52.75 24.19 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.429 179.242 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.41 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 22.1 m-20 -50.95 -39.3 54.64 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.743 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.402 ' N ' ' CD2' ' A' ' 55' ' ' LEU . 0.3 OUTLIER -70.65 -43.68 68.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.283 179.592 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.72 -35.87 69.04 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.53 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.41 ' CD1' ' HA ' ' A' ' 54' ' ' ASN . 11.9 mt -71.12 -42.56 75.9 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.31 178.723 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.1 m -58.89 -49.68 76.88 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.406 179.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 36.0 mt -60.79 -53.49 48.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.552 179.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.84 -34.69 71.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.503 179.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.67 -49.7 75.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.269 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.655 ' O ' HG12 ' A' ' 66' ' ' ILE . 1.0 OUTLIER -55.76 -54.67 41.53 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.405 179.186 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.0 -58.08 3.41 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.218 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.17 -24.53 63.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.881 0.372 . . . . 0.0 110.552 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.14 -29.44 31.62 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.633 179.496 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.655 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -73.0 -34.84 47.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.278 -179.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -87.61 -28.28 22.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.973 -179.163 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.409 ' C ' ' CG2' ' A' ' 69' ' ' THR . 48.0 t -101.31 17.63 22.1 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.409 ' CG2' ' C ' ' A' ' 68' ' ' SER . 0.8 OUTLIER -161.46 -168.02 1.89 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.612 179.376 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.83 39.06 3.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.232 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -51.66 152.7 2.68 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.328 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.7 m -86.12 147.41 26.17 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.803 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -30.93 65.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.585 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -46.28 88.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.282 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -60.42 -33.77 73.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.368 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 23.0 mm -71.07 -35.13 57.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.46 179.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -62.39 -45.46 93.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.562 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.8 tptp -67.01 -49.03 66.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.449 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -56.73 -34.1 67.18 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.425 ' CZ ' HD11 ' A' ' 27' ' ' LEU . 15.4 t80 -64.8 -35.64 81.73 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.42 -0.955 . . . . 0.0 108.42 177.669 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.52 -36.92 76.86 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.896 178.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.23 -36.87 78.71 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 178.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mt -75.75 -31.75 59.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.944 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 87.9 t -67.13 -34.17 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.23 179.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 16.2 tptt -72.13 -49.36 36.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.095 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 t -61.78 -40.84 96.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.323 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.7 p -64.41 -48.95 73.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.438 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.91 -44.04 49.93 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.595 179.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.18 -29.72 66.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.564 179.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 9.1 tt -65.43 -48.96 70.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.807 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.6 mt -62.33 -45.63 92.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.203 0.525 . . . . 0.0 109.665 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 60.3 p -54.79 -42.94 72.4 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.382 179.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.06 -45.23 94.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.43 179.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.93 -49.11 72.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.239 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -56.4 -38.69 71.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.414 179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.62 -32.27 73.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.029 179.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -69.55 -58.18 4.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.249 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.55 -45.87 88.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.343 -179.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -62.88 -35.85 81.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.865 0.364 . . . . 0.0 110.875 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -70.43 -52.91 18.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.904 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -60.99 -72.4 0.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.864 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -94.13 -177.57 4.34 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.834 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.723 179.987 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.712 0.291 . . . . 0.0 111.001 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.727 ' HG ' HG21 ' A' ' 66' ' ' ILE . 1.3 mt -55.18 -32.81 62.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.004 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.501 HG13 ' N ' ' A' ' 23' ' ' LYS . 11.3 p -53.33 -46.0 57.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.309 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.501 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -59.66 -46.31 89.43 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.027 0.441 . . . . 0.0 110.537 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.49 ' CG1' HG23 ' A' ' 59' ' ' ILE . 20.6 t -56.92 -43.82 81.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.665 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -63.71 -37.53 94.86 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.644 -0.789 . . . . 0.0 111.891 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.06 -47.94 79.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.895 0.379 . . . . 0.0 110.224 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.623 HD12 ' CE2' ' A' ' 80' ' ' TYR . 0.8 OUTLIER -61.22 -41.02 96.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.072 179.387 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.06 -38.58 62.6 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 mptt -65.85 -40.54 91.8 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.496 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.4 mmt85 -63.06 -33.3 75.15 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.775 178.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.578 HD12 ' CD1' ' A' ' 59' ' ' ILE . 0.4 OUTLIER -62.58 -49.25 75.98 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.218 179.281 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.91 -37.58 74.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.162 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 tptm -59.02 -43.5 91.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.288 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.822 ' O ' HG23 ' A' ' 38' ' ' VAL . 14.1 m-85 -62.47 -40.53 96.96 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.324 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.06 -45.41 79.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.668 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -59.67 -55.27 36.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.575 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 24.1 t -56.08 -38.0 51.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.933 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 1.026 HG11 HG11 ' A' ' 48' ' ' VAL . 49.2 t -75.25 -33.19 27.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.87 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.03 -32.52 73.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.43 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -83.08 -1.79 53.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.537 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.2 mt -89.54 -56.18 3.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.793 0.33 . . . . 0.0 111.006 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.04 3.66 4.45 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.652 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -116.69 138.34 51.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.771 0.32 . . . . 0.0 110.761 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.785 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 58.18 52.05 54.83 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.275 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.506 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 5.8 mmtm -72.05 -43.19 10.32 Favored Pre-proline 0 C--N 1.329 -0.289 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.506 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.5 Cg_exo -53.42 -48.92 19.33 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.226 1.95 . . . . 0.0 112.771 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -65.46 -38.68 90.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.531 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.026 HG11 HG11 ' A' ' 38' ' ' VAL . 25.8 t -72.4 -56.95 8.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.621 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.573 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 28.5 p30 -58.95 -26.17 64.18 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.067 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 54.7 ttm-85 -73.69 -46.37 46.69 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.97 0.414 . . . . 0.0 111.504 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -74.96 -47.44 29.43 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.525 0.679 . . . . 0.0 109.203 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.621 HG13 ' O ' ' A' ' 48' ' ' VAL . 3.7 mt -57.91 -30.92 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.759 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.25 178.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.573 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -70.23 -55.16 9.97 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.594 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.78 ' HA ' HD12 ' A' ' 57' ' ' ILE . 28.2 p30 -59.73 -25.7 65.03 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 120.871 -0.331 . . . . 0.0 111.181 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.845 ' O ' HD12 ' A' ' 59' ' ' ILE . 45.5 mt -77.44 -46.51 22.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.746 0.308 . . . . 0.0 110.226 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.441 ' HG2' HD13 ' A' ' 31' ' ' LEU . 0.5 OUTLIER -56.69 -37.72 71.27 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.634 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.78 HD12 ' HA ' ' A' ' 54' ' ' ASN . 9.7 mt -71.4 -39.93 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.109 178.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.675 ' O ' HD12 ' A' ' 62' ' ' LEU . 16.1 t -57.76 -55.12 38.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.506 179.521 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.845 HD12 ' O ' ' A' ' 55' ' ' LEU . 2.7 mp -58.87 -47.8 88.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.424 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -60.31 -33.95 73.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.352 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.58 -49.5 77.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.327 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.675 HD12 ' O ' ' A' ' 58' ' ' SER . 1.5 mp -55.5 -52.9 62.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.467 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.476 ' HE1' ' HB ' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.25 -54.07 7.51 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.111 179.769 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.45 -24.83 67.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.598 179.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -81.9 -29.11 32.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.336 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.727 HG21 ' HG ' ' A' ' 21' ' ' LEU . 1.9 mm -71.98 -37.63 61.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.031 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.86 -27.96 16.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.571 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.766 ' O ' HG23 ' A' ' 69' ' ' THR . 1.6 t -104.12 24.54 11.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.704 0.288 . . . . 0.0 111.58 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.766 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 175.89 150.05 0.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.823 179.512 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.7 mtt -83.94 72.91 10.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.916 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 8.3 mmm -74.62 138.81 43.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.688 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.2 m -78.06 139.37 39.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.855 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -55.48 -35.02 65.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.665 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -58.27 -44.47 88.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.351 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -61.67 -32.86 73.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.285 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.591 HD13 HD23 ' A' ' 62' ' ' LEU . 22.8 mm -73.1 -36.65 51.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.742 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 37.5 tp60 -60.22 -52.28 65.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.667 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.53 -46.3 86.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.432 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.56 ' CD ' HD21 ' A' ' 62' ' ' LEU . 19.2 mt-10 -56.7 -34.21 67.21 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 178.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.902 ' O ' HG23 ' A' ' 84' ' ' VAL . 36.5 t80 -64.5 -36.28 83.67 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.44 -37.07 77.22 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.89 178.462 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.58 -36.07 75.52 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.257 0.551 . . . . 0.0 109.642 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 20.9 mt -76.1 -31.66 58.8 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.066 178.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.902 HG23 ' O ' ' A' ' 80' ' ' TYR . 51.1 t -69.41 -34.43 62.26 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.518 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 18.2 mmtt -71.98 -49.18 39.47 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.357 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.572 ' HB3' HD21 ' A' ' 55' ' ' LEU . 0.3 OUTLIER -67.68 -42.28 82.37 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.463 179.532 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.411 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 72.6 m -65.08 -47.2 78.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.475 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -54.3 -44.67 72.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.623 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.64 -35.03 79.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.61 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.426 HD23 HD23 ' A' ' 91' ' ' LEU . 5.3 tt -60.24 -45.91 91.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.849 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.426 HD23 HD23 ' A' ' 90' ' ' LEU . 7.1 mt -61.58 -51.95 66.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.069 0.462 . . . . 0.0 109.809 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.1 m -56.11 -41.28 75.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.353 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.21 -40.51 90.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.547 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 1.007 HD21 HG22 ' A' ' 38' ' ' VAL . 5.4 mp -63.85 -44.14 94.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.417 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -55.85 -50.63 70.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.679 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 16.3 pttp -62.39 -28.65 69.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.101 0.477 . . . . 0.0 109.782 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.417 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.514 ' O ' HG23 ' A' ' 24' ' ' VAL . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.111 0 CA-C-O 120.647 0.26 . . . . 0.0 111.104 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.2 mp -53.89 -32.71 54.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.129 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.536 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.8 p -55.35 -49.68 71.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.268 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.536 ' N ' HG13 ' A' ' 22' ' ' VAL . 35.3 mttt -68.92 -43.91 74.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.897 0.379 . . . . 0.0 110.48 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 20' ' ' SER . 21.0 t -57.12 -40.18 71.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.286 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.53 -39.73 94.04 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.679 -0.772 . . . . 0.0 111.614 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -32.52 72.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.896 0.379 . . . . 0.0 110.087 179.307 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.686 HD13 HD13 ' A' ' 83' ' ' LEU . 0.3 OUTLIER -68.1 -49.9 58.25 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.772 179.137 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -52.99 -33.39 51.27 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.96 -39.3 79.56 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.416 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.445 ' HG3' ' CZ ' ' A' ' 34' ' ' PHE . 2.0 tpt180 -64.12 -31.97 73.36 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.442 ' CD1' HD12 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -65.96 -46.25 78.79 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.066 179.097 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -58.06 -37.37 74.3 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.859 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -59.75 -49.78 76.4 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.949 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.743 ' O ' HG23 ' A' ' 38' ' ' VAL . 11.3 m-85 -60.82 -37.87 83.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.38 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 27.3 m-80 -58.4 -43.54 88.61 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.411 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -51.15 71.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.147 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 36.8 t -57.46 -37.71 59.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.333 179.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.842 ' HA ' HD12 ' A' ' 41' ' ' LEU . 95.5 t -68.57 -41.84 83.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.639 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.8 t -58.17 -34.35 70.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.672 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -86.5 -16.15 37.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.326 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.842 HD12 ' HA ' ' A' ' 38' ' ' VAL . 12.4 mt -74.53 -50.67 17.21 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.167 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 0.1 OUTLIER 67.19 10.47 7.74 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.716 -179.706 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -131.4 152.92 50.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.729 0.299 . . . . 0.0 110.908 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 56.47 33.11 61.68 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.359 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.535 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 17.8 mmtt -53.54 -57.1 18.58 Favored Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 111.53 0.196 . . . . 0.0 111.53 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 14.2 Cg_endo -57.41 -41.76 68.94 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.391 2.061 . . . . 0.0 113.004 -179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -64.96 -50.77 65.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.841 0.353 . . . . 0.0 111.509 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.539 ' O ' HG13 ' A' ' 52' ' ' ILE . 8.4 p -69.2 -49.74 58.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.703 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.521 ' N ' HG13 ' A' ' 48' ' ' VAL . 44.8 p30 -61.83 -25.14 67.33 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.105 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.438 ' N ' ' OD1' ' A' ' 49' ' ' ASN . 1.0 OUTLIER -73.47 -47.76 38.85 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.808 0.337 . . . . 0.0 111.097 179.875 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -74.76 -46.62 35.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.509 0.671 . . . . 0.0 109.382 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.898 HD11 HD11 ' A' ' 90' ' ' LEU . 1.4 mt -57.27 -32.57 41.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 CA-C-N 114.801 -1.09 . . . . 0.0 110.299 178.852 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 9.0 tttt -69.29 -53.26 20.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.348 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.93 ' HA ' HD12 ' A' ' 57' ' ' ILE . 3.9 m120 -53.78 -29.22 39.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.83 0.348 . . . . 0.0 110.861 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.89 HD12 ' HA ' ' A' ' 52' ' ' ILE . 4.1 mt -77.16 -47.92 19.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.243 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' A' ' 57' ' ' ILE . 0.0 OUTLIER -56.39 -31.3 63.71 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 178.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.93 HD12 ' HA ' ' A' ' 54' ' ' ASN . 14.8 mt -71.6 -43.57 71.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.107 178.225 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.747 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.2 m -58.35 -53.14 61.69 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.772 179.699 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.442 HD12 ' CD1' ' A' ' 31' ' ' LEU . 23.0 mt -57.04 -52.43 56.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.791 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.4 -33.79 68.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.306 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -58.63 -49.35 77.82 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.107 179.232 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.747 HD12 ' O ' ' A' ' 58' ' ' SER . 1.9 mp -55.34 -53.22 58.96 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.446 179.127 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.461 ' HE3' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.4 -53.05 9.19 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.042 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.4 ' O ' ' CB ' ' A' ' 68' ' ' SER . . . -63.27 -25.09 68.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.653 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 26.4 mtpt -82.03 -28.87 32.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.132 0.491 . . . . 0.0 110.641 179.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.653 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.0 mm -71.49 -41.84 72.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.394 -179.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.66 -29.12 16.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.799 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.782 ' O ' HG23 ' A' ' 69' ' ' THR . 0.3 OUTLIER -101.41 21.8 13.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.527 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.782 HG23 ' O ' ' A' ' 68' ' ' SER . 0.5 OUTLIER 178.05 155.88 0.38 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.93 179.502 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.97 81.65 4.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.801 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.4 mmm -86.68 141.44 28.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.948 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.8 m -77.96 139.89 39.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.924 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -53.99 -31.99 52.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.95 0.405 . . . . 0.0 110.878 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -59.3 -49.09 79.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.535 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -61.87 -32.3 72.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.44 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.584 ' CD1' HD23 ' A' ' 62' ' ' LEU . 20.5 mm -71.75 -33.94 50.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.74 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -46.6 76.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.926 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 21.8 mmtt -63.4 -51.25 66.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.75 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -56.3 -33.71 65.82 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.923 ' O ' HG23 ' A' ' 84' ' ' VAL . 2.9 t80 -64.44 -36.19 83.37 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.551 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.36 -36.65 77.06 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.959 178.573 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.91 -39.13 80.58 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 121.285 0.565 . . . . 0.0 109.644 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.686 HD13 HD13 ' A' ' 27' ' ' LEU . 2.1 mt -75.13 -29.49 60.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.095 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.923 HG23 ' O ' ' A' ' 80' ' ' TYR . 64.0 t -71.04 -37.4 67.35 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.269 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -49.31 64.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.181 179.397 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.589 ' HB3' HD21 ' A' ' 55' ' ' LEU . 0.2 OUTLIER -67.03 -35.52 80.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.145 179.287 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.435 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 7.3 t -65.69 -46.84 77.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.439 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.588 ' OE1' HG12 ' A' ' 84' ' ' VAL . 25.8 mt-10 -56.13 -47.24 78.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.117 0.484 . . . . 0.0 110.649 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.44 -31.37 72.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.735 179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.898 HD11 HD11 ' A' ' 52' ' ' ILE . 4.6 tt -63.99 -42.2 97.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.954 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.4 mt -64.6 -50.34 67.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.201 0.524 . . . . 0.0 110.016 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.6 m -59.08 -39.18 81.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.838 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.4 -53.27 17.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.098 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.494 HD21 HG22 ' A' ' 38' ' ' VAL . 7.1 mp -58.33 -33.59 69.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.024 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.98 -51.78 50.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.851 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 10.0 pttp -57.53 -28.46 63.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.188 0.518 . . . . 0.0 110.078 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.8 mttp . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.946 -179.806 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 86.2 p . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.807 0.337 . . . . 0.0 110.843 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.453 HD21 ' HB ' ' A' ' 66' ' ' ILE . 27.9 mt -54.83 -32.89 61.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.945 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.491 HG13 ' N ' ' A' ' 23' ' ' LYS . 12.3 p -59.11 -45.65 92.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.228 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.491 ' N ' HG13 ' A' ' 22' ' ' VAL . 8.0 mmtt -57.98 -44.59 87.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.059 0.457 . . . . 0.0 110.661 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.44 HG12 ' CG2' ' A' ' 59' ' ' ILE . 14.9 t -56.81 -44.93 82.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.612 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.73 -37.45 94.29 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.721 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.1 m -57.01 -47.27 81.24 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.993 0.425 . . . . 0.0 110.35 179.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.64 HD13 ' CE2' ' A' ' 80' ' ' TYR . 5.1 tp -60.74 -41.4 95.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.166 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -54.37 -36.82 64.29 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.96 -38.71 86.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.681 178.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 mpt_? -63.18 -34.87 78.58 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.89 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.55 HD12 HD12 ' A' ' 59' ' ' ILE . 13.2 mt -63.17 -49.71 73.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.197 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.99 -36.86 73.24 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.11 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.0 tptm -59.32 -44.36 92.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.236 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.815 ' O ' HG23 ' A' ' 38' ' ' VAL . 7.6 m-85 -62.57 -37.59 86.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.165 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -58.71 -41.6 86.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.439 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.86 -55.15 32.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.495 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.6 t -55.83 -37.87 49.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.573 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 1.024 HG21 HG11 ' A' ' 48' ' ' VAL . 61.1 t -74.22 -35.07 39.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.519 179.56 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -35.3 71.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.196 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.2 -31.0 68.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.838 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.534 ' O ' HD12 ' A' ' 41' ' ' LEU . 1.3 pp -117.31 80.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.743 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.74 -27.64 5.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.245 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -58.64 98.9 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.877 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.555 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 95.66 40.45 4.14 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.5 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.451 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -71.58 -49.98 10.81 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.605 0.24 . . . . 0.0 111.181 -179.952 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.451 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.1 Cg_exo -53.28 -40.36 77.98 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.427 2.085 . . . . 0.0 112.657 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -59.93 -50.56 73.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.02 0.438 . . . . 0.0 110.817 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.024 HG11 HG21 ' A' ' 38' ' ' VAL . 4.0 t -66.2 -55.32 19.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.749 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.583 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 83.9 m-20 -52.92 -27.86 20.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.049 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 48.8 ttt-85 -71.75 -53.4 13.55 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.916 0.388 . . . . 0.0 111.899 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.4 ' HA ' HD21 ' A' ' 54' ' ' ASN . 6.0 mt-30 -69.74 -43.84 71.47 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.786 0.803 . . . . 0.0 109.082 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.601 HG13 HG12 ' A' ' 48' ' ' VAL . 1.4 mt -59.52 -29.99 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.869 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.212 178.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.583 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -69.94 -55.11 10.51 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.403 179.717 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.899 ' HA ' HD12 ' A' ' 57' ' ' ILE . 27.5 p30 -60.19 -25.7 65.78 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.917 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.487 HD22 HD23 ' A' ' 83' ' ' LEU . 19.4 mt -79.84 -39.07 31.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.731 0.3 . . . . 0.0 110.198 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.73 -36.39 82.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 178.326 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.899 HD12 ' HA ' ' A' ' 54' ' ' ASN . 10.2 mt -69.93 -39.23 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.94 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.733 ' O ' HD12 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -57.37 -45.87 83.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.128 179.407 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.55 HD12 HD12 ' A' ' 31' ' ' LEU . 64.0 mt -61.52 -51.1 76.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.127 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -58.98 -33.59 70.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.094 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -57.53 -49.42 76.39 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.885 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.733 HD12 ' O ' ' A' ' 58' ' ' SER . 1.1 mp -55.23 -51.58 66.14 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.108 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.457 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.35 -54.79 6.75 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.97 179.819 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.47 -25.18 67.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.641 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.439 ' O ' HG23 ' A' ' 69' ' ' THR . 50.8 mtmt -82.13 -29.49 31.63 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 121.105 0.478 . . . . 0.0 110.483 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.8 mm -70.84 -36.53 64.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.939 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.2 mmmm -94.85 1.23 55.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.93 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.454 ' O ' HG22 ' A' ' 69' ' ' THR . 10.1 m -134.12 21.25 3.76 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.454 HG22 ' O ' ' A' ' 68' ' ' SER . 1.4 p -160.22 -167.6 1.97 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.565 179.343 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.5 mtm -125.37 33.13 5.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.492 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.1 mtp -58.04 123.69 16.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.091 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.0 m -67.58 145.57 54.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.742 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -55.15 -30.82 60.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.652 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -59.0 -45.55 90.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.314 179.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -33.95 72.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.094 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.592 ' CD1' HD23 ' A' ' 62' ' ' LEU . 18.3 mm -72.96 -33.95 44.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.425 179.326 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.22 -46.2 91.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.564 179.655 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -66.37 -48.54 69.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.467 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.552 ' O ' HD12 ' A' ' 83' ' ' LEU . 5.1 mt-10 -56.57 -33.99 66.7 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.861 ' O ' HG23 ' A' ' 84' ' ' VAL . 9.3 t80 -64.35 -36.52 84.39 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.71 -37.45 76.56 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.963 178.521 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.29 -34.07 73.24 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 121.203 0.525 . . . . 0.0 109.803 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.631 HD13 ' CD2' ' A' ' 27' ' ' LEU . 1.3 mt -76.78 -31.44 57.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.04 178.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.861 HG23 ' O ' ' A' ' 80' ' ' TYR . 56.7 t -68.59 -36.83 76.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.537 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.02 -49.15 39.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.564 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.76 -41.16 92.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.625 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.415 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 43.1 m -63.62 -50.35 69.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.574 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.58 -42.85 68.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.728 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -69.92 -27.05 64.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.81 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.508 HD23 HD23 ' A' ' 91' ' ' LEU . 5.5 tt -69.83 -49.11 55.73 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.017 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.565 HD21 ' CD1' ' A' ' 34' ' ' PHE . 7.2 mt -62.32 -50.9 69.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.123 0.487 . . . . 0.0 109.916 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.7 m -56.38 -34.2 66.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.725 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.18 -53.13 21.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.272 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.676 HD22 HG22 ' A' ' 38' ' ' VAL . 2.8 pp -68.63 -28.84 67.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.103 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.443 ' HB2' ' O ' ' A' ' 91' ' ' LEU . 10.0 tt0 -63.87 -54.13 39.68 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.864 0.364 . . . . 0.0 110.492 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -67.14 -29.52 69.25 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.58 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.922 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.445 ' O ' HG23 ' A' ' 24' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.903 0.382 . . . . 0.0 110.866 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.441 ' HG ' HG21 ' A' ' 66' ' ' ILE . 1.6 mp -58.57 -32.99 69.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.975 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.521 HG13 ' N ' ' A' ' 23' ' ' LYS . 9.8 p -60.51 -47.63 91.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.335 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.521 ' N ' HG13 ' A' ' 22' ' ' VAL . 12.5 mttm -59.81 -49.93 75.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.081 0.467 . . . . 0.0 110.349 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.657 HG12 HG23 ' A' ' 59' ' ' ILE . 10.7 t -56.85 -40.79 73.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.256 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -64.54 -37.57 94.59 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.479 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -56.86 -43.75 81.52 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.131 0.491 . . . . 0.0 109.897 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.87 HD12 HD11 ' A' ' 59' ' ' ILE . 0.2 OUTLIER -63.36 -40.15 96.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.732 178.909 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -53.82 -36.91 63.01 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.04 -42.63 84.48 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.675 178.63 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.55 -31.19 72.28 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.851 178.811 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.951 HD22 HD12 ' A' ' 59' ' ' ILE . 1.7 tp -63.58 -50.9 67.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.163 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.21 -34.44 72.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.176 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -45.27 94.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.312 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.882 ' O ' HG23 ' A' ' 38' ' ' VAL . 7.7 m-85 -60.38 -44.1 95.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.232 179.493 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -57.24 -37.28 72.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.58 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -61.17 -55.15 35.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.362 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 39.5 t -57.82 -37.61 61.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.368 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.882 HG23 ' O ' ' A' ' 34' ' ' PHE . 47.5 t -67.34 -43.7 87.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.853 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 m -55.81 -39.57 71.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.723 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.71 -27.74 68.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.031 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 44.2 mt -70.66 -40.27 73.11 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.999 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 63.61 14.16 7.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.41 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -138.42 158.45 44.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.688 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.769 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 58.7 30.53 65.88 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.27 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.612 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 1.6 mmtp -54.65 -52.08 73.12 Favored Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.612 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 11.0 Cg_endo -55.03 -49.28 17.13 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.447 2.098 . . . . 0.0 113.316 -179.092 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -59.66 -50.27 74.53 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.54 0.21 . . . . 0.0 111.436 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.769 HG23 ' O ' ' A' ' 44' ' ' GLY . 2.7 t -66.23 -55.39 19.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 120.841 0.353 . . . . 0.0 110.668 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.635 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 13.8 m120 -52.7 -29.99 29.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.204 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -49.84 38.61 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.497 ' HB2' HD12 ' A' ' 90' ' ' LEU . 39.6 mt-30 -71.33 -45.96 61.73 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 179.682 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.749 ' CD1' HG12 ' A' ' 48' ' ' VAL . 3.6 mt -57.13 -30.4 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.461 178.795 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.893 ' CD ' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -69.12 -50.87 44.06 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 178.634 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.918 ' HA ' HD12 ' A' ' 57' ' ' ILE . 4.6 m120 -51.29 -38.69 54.21 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.385 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 27.9 mt -70.92 -43.4 68.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.084 179.331 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.82 ' HG2' HD23 ' A' ' 31' ' ' LEU . 1.6 mm-40 -56.65 -36.91 70.06 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.436 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.918 HD12 ' HA ' ' A' ' 54' ' ' ASN . 10.2 mt -70.98 -41.75 76.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.188 178.639 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.889 ' O ' HD12 ' A' ' 62' ' ' LEU . 29.7 t -58.53 -52.1 67.07 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.519 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.951 HD12 HD22 ' A' ' 31' ' ' LEU . 36.8 mt -61.5 -52.64 58.73 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.661 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.422 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 1.4 t70 -56.55 -34.84 67.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.311 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.79 -49.22 78.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.852 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.889 HD12 ' O ' ' A' ' 58' ' ' SER . 1.3 mp -55.62 -56.56 18.87 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.041 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.428 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.73 -54.44 7.89 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.762 0.315 . . . . 0.0 110.841 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.12 -24.44 66.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.918 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.481 ' O ' HG23 ' A' ' 69' ' ' THR . 10.1 mtmt -82.2 -30.06 31.09 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.223 0.535 . . . . 0.0 110.57 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.648 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -72.29 -33.74 47.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.983 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.0 mmtt -89.53 -24.11 21.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.051 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.548 ' O ' HG22 ' A' ' 69' ' ' THR . 58.3 m -115.38 19.08 15.74 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.548 HG22 ' O ' ' A' ' 68' ' ' SER . 0.1 OUTLIER -163.08 166.46 23.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.588 179.196 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -107.3 43.72 1.15 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.567 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -53.71 142.18 24.17 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.174 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.4 m -79.22 148.97 32.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.774 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.77 -31.15 68.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.594 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -59.22 -45.39 91.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.443 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -34.33 75.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.421 179.551 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.675 ' CD1' HD23 ' A' ' 62' ' ' LEU . 23.3 mm -71.49 -33.96 51.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.72 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -63.88 -51.75 63.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.783 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -60.94 -47.09 88.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.743 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -56.44 -33.17 65.6 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.877 ' O ' HG23 ' A' ' 84' ' ' VAL . 4.6 t80 -64.32 -37.71 88.46 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -69.9 -37.67 76.05 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.15 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.32 -33.54 72.53 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 121.114 0.483 . . . . 0.0 109.873 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.691 HD12 ' HA ' ' A' ' 80' ' ' TYR . 4.7 mt -77.77 -30.96 51.7 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.05 178.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.877 HG23 ' O ' ' A' ' 80' ' ' TYR . 52.7 t -69.42 -38.19 76.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.746 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.408 ' O ' ' HG2' ' A' ' 88' ' ' GLU . 0.8 OUTLIER -72.34 -46.93 53.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.732 179.761 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 m -68.94 -36.6 78.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.941 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.509 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 58.9 m -69.94 -51.12 35.36 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.039 -179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 12.2 pt-20 -55.39 -42.95 74.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.947 0.403 . . . . 0.0 110.797 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.402 ' N ' ' HG3' ' A' ' 88' ' ' GLU . 37.8 t70 -71.31 -28.23 63.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.849 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.786 HD23 HD23 ' A' ' 91' ' ' LEU . 1.5 tt -68.22 -50.21 55.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.297 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.786 HD23 HD23 ' A' ' 90' ' ' LEU . 5.8 mt -63.76 -41.57 97.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.361 0.6 . . . . 0.0 109.715 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.7 m -56.55 -39.79 74.01 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.767 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.417 ' O ' ' HG3' ' A' ' 97' ' ' LYS . . . -66.83 -54.32 23.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.344 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.417 ' CD2' ' O ' ' A' ' 90' ' ' LEU . 0.3 OUTLIER -63.88 -25.93 68.38 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.798 179.83 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -40.03 77.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.96 0.409 . . . . 0.0 110.128 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.1 mtpt -64.14 -43.52 94.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.012 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.417 ' HG3' ' O ' ' A' ' 93' ' ' ALA . 12.9 mttm . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.952 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.7 t . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.689 0.28 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.689 ' HG ' HG21 ' A' ' 66' ' ' ILE . 0.7 OUTLIER -54.84 -32.91 61.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.206 -179.914 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.5 t -61.97 -52.57 58.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.173 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.69 -45.53 63.52 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.936 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.567 ' CG1' HG23 ' A' ' 59' ' ' ILE . 30.6 t -60.1 -48.53 87.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.719 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.76 -39.71 98.29 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.011 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.1 m -56.7 -42.15 78.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.022 0.439 . . . . 0.0 110.236 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.744 HD23 HD13 ' A' ' 83' ' ' LEU . 20.1 tp -64.71 -41.35 96.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.145 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.7 ttmm -52.81 -39.35 62.32 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -65.05 -42.37 94.32 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.423 178.309 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.36 -31.6 72.8 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.824 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.629 HD21 HG22 ' A' ' 52' ' ' ILE . 3.3 tt -61.97 -50.37 72.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.068 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -57.74 -38.83 76.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.164 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -57.89 -44.59 86.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.251 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.785 ' O ' HG23 ' A' ' 38' ' ' VAL . 23.5 m-85 -59.71 -43.19 94.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.394 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -56.48 -40.61 75.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.397 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.88 -52.07 66.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.278 179.488 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.2 t -59.76 -37.79 73.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.497 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.892 HG22 HD21 ' A' ' 94' ' ' LEU . 60.3 t -67.47 -43.86 87.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.802 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.8 m -61.95 -29.22 70.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.443 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.28 -31.43 71.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.845 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.599 ' O ' HD12 ' A' ' 41' ' ' LEU . 1.3 pp -113.84 79.1 1.21 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.026 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 43' ' ' ASP . 6.4 mmtp -46.55 99.23 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.91 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' A' ' 42' ' ' LYS . 33.9 t0 178.22 146.62 0.14 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.919 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.625 ' O ' HG12 ' A' ' 48' ' ' VAL . . . 50.79 42.2 45.42 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.706 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.58 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 7.8 mmtp -59.39 -51.62 80.06 Favored Pre-proline 0 C--N 1.329 -0.303 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.58 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 28.9 Cg_endo -63.78 -42.52 19.75 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.201 1.934 . . . . 0.0 112.943 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -65.15 -50.55 65.54 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.823 0.344 . . . . 0.0 111.193 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.625 HG12 ' O ' ' A' ' 44' ' ' GLY . 14.5 p -63.51 -55.23 24.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.598 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.592 ' HA ' HG13 ' A' ' 52' ' ' ILE . 60.3 m-20 -51.58 -31.2 23.8 Favored 'General case' 0 N--CA 1.461 0.116 0 CA-C-O 120.867 0.365 . . . . 0.0 110.702 179.385 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.09 -44.77 83.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.322 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -70.95 -48.7 51.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.269 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.698 ' HA ' HD12 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -57.46 -41.1 78.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.031 179.442 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.564 ' HD3' HD11 ' A' ' 57' ' ' ILE . 1.1 tttt -58.36 -52.43 65.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.684 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.899 ' HA ' HD12 ' A' ' 57' ' ' ILE . 4.0 m120 -52.04 -39.81 60.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.944 0.402 . . . . 0.0 110.512 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.88 HD21 ' HB3' ' A' ' 86' ' ' SER . 10.5 mt -68.39 -44.44 75.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.594 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.65 -36.38 69.46 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.899 HD12 ' HA ' ' A' ' 54' ' ' ASN . 10.5 mt -71.35 -42.48 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.289 178.641 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.746 ' O ' HD12 ' A' ' 62' ' ' LEU . 2.8 m -60.4 -52.23 66.13 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.566 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.567 HG23 ' CG1' ' A' ' 24' ' ' VAL . 6.9 mt -58.13 -50.43 78.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.86 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -59.33 -37.16 77.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.813 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.66 -50.0 74.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.997 0.427 . . . . 0.0 110.676 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.746 HD12 ' O ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -55.72 -55.44 32.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.547 179.372 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.431 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -44.9 -54.61 6.27 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.263 -179.848 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.78 -25.93 66.9 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.678 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.55 ' HA ' HG23 ' A' ' 69' ' ' THR . 3.6 mtmp? -82.11 -29.49 31.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.024 0.44 . . . . 0.0 110.697 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.689 HG21 ' HG ' ' A' ' 21' ' ' LEU . 1.3 mm -73.12 -33.94 43.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.28 -179.293 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 14.3 mmtm -93.03 1.02 57.48 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.514 ' O ' HG22 ' A' ' 69' ' ' THR . 17.0 m -147.23 21.76 1.21 Allowed 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.55 HG23 ' HA ' ' A' ' 65' ' ' LYS . 0.2 OUTLIER -161.85 158.6 25.75 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.752 179.362 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -97.39 43.52 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.318 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.4 129.13 21.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.341 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.427 HG22 ' H ' ' A' ' 74' ' ' GLU . 12.4 m -71.36 137.83 48.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.578 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.84 -30.29 22.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.717 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.427 ' H ' HG22 ' A' ' 72' ' ' THR . 1.1 tt0 -59.34 -43.92 92.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.377 179.511 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 15.1 tp60 -68.05 -33.97 75.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.417 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.655 ' CD1' HD23 ' A' ' 62' ' ' LEU . 22.8 mm -69.58 -39.46 78.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.498 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -41.35 96.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.669 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.25 -48.24 68.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.453 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -56.57 -34.25 66.96 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.858 ' O ' HG23 ' A' ' 84' ' ' VAL . 52.5 t80 -65.04 -36.81 85.55 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.407 -0.961 . . . . 0.0 108.407 177.595 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -69.84 -37.62 76.24 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.775 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.94 -33.61 72.13 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.744 HD13 HD23 ' A' ' 27' ' ' LEU . 2.0 mt -76.88 -32.39 57.44 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.105 179.007 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.858 HG23 ' O ' ' A' ' 80' ' ' TYR . 43.2 t -69.52 -36.66 72.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.495 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.404 ' O ' ' HG3' ' A' ' 88' ' ' GLU . 4.4 mmtm -72.13 -42.66 65.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.566 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.88 ' HB3' HD21 ' A' ' 55' ' ' LEU . 0.3 OUTLIER -73.91 -35.65 64.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.492 179.587 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.431 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 34.8 m -68.59 -50.61 50.32 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.645 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 85' ' ' LYS . 1.6 pp20? -60.19 -38.7 84.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.323 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -65.85 -32.86 74.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.235 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.535 HD23 ' C ' ' A' ' 90' ' ' LEU . 5.7 tt -64.66 -44.07 91.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.667 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.0 mt -62.09 -43.54 98.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.789 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 57.9 m -54.66 -46.68 74.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.449 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.3 -40.71 97.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.415 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.892 HD21 HG22 ' A' ' 38' ' ' VAL . 1.3 mp -57.72 -49.75 75.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.56 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.83 -42.33 75.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.592 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.13 -38.6 80.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.571 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.405 ' CD ' ' HA ' ' A' ' 94' ' ' LEU . 7.2 mttt . . . . . 0 C--N 1.33 -0.261 0 CA-C-O 121.371 0.605 . . . . 0.0 111.069 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.2 p . . . . . 0 C--O 1.23 0.047 0 CA-C-O 120.872 0.368 . . . . 0.0 110.829 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.5 ' HG ' HG21 ' A' ' 66' ' ' ILE . 13.6 mt -54.6 -32.76 59.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.95 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.504 HG13 ' N ' ' A' ' 23' ' ' LYS . 9.9 p -59.13 -47.06 91.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.022 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.504 ' N ' HG13 ' A' ' 22' ' ' VAL . 5.6 tttt -61.54 -41.98 98.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.077 0.465 . . . . 0.0 110.3 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.564 ' CG1' HG23 ' A' ' 59' ' ' ILE . 40.8 t -57.03 -44.88 83.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.49 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.17 -37.69 94.92 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.711 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.44 -44.57 84.82 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.895 0.378 . . . . 0.0 110.222 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.679 HD23 HD13 ' A' ' 83' ' ' LEU . 20.0 tp -62.65 -41.79 99.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.088 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.3 tptt -53.28 -38.5 63.15 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.9 mptt -65.15 -40.67 94.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.32 178.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.453 ' HD3' HD12 ' A' ' 27' ' ' LEU . 60.8 mtp180 -63.44 -31.32 72.45 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.739 178.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.518 HD13 ' CD1' ' A' ' 59' ' ' ILE . 0.2 OUTLIER -63.09 -49.09 75.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.103 179.143 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -59.48 -37.0 77.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.315 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -50.24 73.56 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.332 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.89 ' O ' HG23 ' A' ' 38' ' ' VAL . 4.1 m-85 -58.78 -45.51 89.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.619 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -51.56 -43.8 62.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.02 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -61.43 -53.92 50.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.566 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 33.5 t -58.63 -37.7 66.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.767 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 1.116 HG22 HD21 ' A' ' 94' ' ' LEU . 39.3 t -71.08 -40.46 75.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.081 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.44 -38.39 77.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.86 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.32 -20.05 63.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.436 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.85 HD12 ' HA ' ' A' ' 38' ' ' VAL . 44.4 mt -75.33 -42.48 54.29 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.211 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.61 14.0 7.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.439 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -131.68 146.53 52.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.704 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.712 ' O ' HG12 ' A' ' 48' ' ' VAL . . . 57.22 27.93 58.22 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.334 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.799 ' HE3' HG12 ' A' ' 38' ' ' VAL . 0.6 OUTLIER -61.92 -49.33 86.08 Favored Pre-proline 0 C--N 1.329 -0.313 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.716 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.633 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 10.8 Cg_endo -55.0 -45.48 40.59 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.146 1.897 . . . . 0.0 112.954 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 50' ' ' ARG . 11.8 pt-20 -70.06 -50.73 38.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.768 0.318 . . . . 0.0 111.479 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.712 HG12 ' O ' ' A' ' 44' ' ' GLY . 8.3 p -62.04 -55.29 25.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.718 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.572 ' HA ' HG13 ' A' ' 52' ' ' ILE . 98.2 m-20 -51.59 -43.79 62.58 Favored 'General case' 0 N--CA 1.463 0.204 0 O-C-N 123.078 0.236 . . . . 0.0 111.399 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.514 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -60.78 -36.04 77.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.773 0.32 . . . . 0.0 110.682 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.514 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 44.6 mt-30 -74.42 -48.57 26.87 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.219 0.533 . . . . 0.0 109.973 179.366 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.861 ' HA ' HD12 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -57.56 -38.86 66.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.923 179.319 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.411 ' O ' HG13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -61.45 -53.2 59.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.597 179.507 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.922 ' HA ' HD12 ' A' ' 57' ' ' ILE . 5.3 m120 -51.54 -36.52 45.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.786 0.327 . . . . 0.0 110.724 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.861 HD12 ' HA ' ' A' ' 52' ' ' ILE . 2.7 mt -72.93 -45.54 57.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.82 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.772 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.4 OUTLIER -56.74 -33.11 66.23 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.779 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.922 HD12 ' HA ' ' A' ' 54' ' ' ASN . 14.5 mt -71.26 -44.19 73.51 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.188 178.311 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.721 ' O ' HD12 ' A' ' 62' ' ' LEU . 8.1 m -59.11 -46.67 87.71 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.377 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.772 HD12 ' HA ' ' A' ' 56' ' ' GLU . 5.7 mt -58.46 -55.07 24.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.732 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -57.9 -33.73 69.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.543 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.84 -49.97 74.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.206 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.721 HD12 ' O ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -55.89 -54.64 42.14 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.264 179.045 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.426 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.03 -54.95 6.04 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.255 179.914 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.27 -25.17 66.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.649 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 24.1 mtpt -82.29 -29.97 30.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.166 0.508 . . . . 0.0 110.62 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -71.99 -34.06 49.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.092 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.64 1.16 55.56 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.238 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.45 ' O ' HG22 ' A' ' 69' ' ' THR . 58.3 m -138.87 21.91 2.65 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.45 HG22 ' O ' ' A' ' 68' ' ' SER . 1.3 p -160.16 179.61 8.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.869 0.366 . . . . 0.0 110.73 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.58 37.36 3.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.565 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 16.7 mmm -56.0 146.18 23.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.125 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.2 m -84.97 142.41 29.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.755 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.99 -29.81 57.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.707 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -46.39 89.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.451 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.46 -34.23 75.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.436 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.639 ' CD1' HD23 ' A' ' 62' ' ' LEU . 27.0 mm -70.58 -33.87 55.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.77 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 8.4 tp60 -66.46 -42.65 87.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.872 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.59 -50.9 56.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.72 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -56.37 -34.09 66.33 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.916 ' O ' HG23 ' A' ' 84' ' ' VAL . 64.9 t80 -64.55 -35.65 81.66 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.627 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -69.55 -37.52 77.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.963 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.25 -37.27 77.15 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.313 0.578 . . . . 0.0 109.589 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.679 HD13 HD23 ' A' ' 27' ' ' LEU . 26.3 mt -75.51 -30.71 59.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.101 178.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.916 HG23 ' O ' ' A' ' 80' ' ' TYR . 61.7 t -69.17 -34.57 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.53 179.347 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.16 -49.11 38.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.464 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 m -68.1 -36.85 80.45 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.568 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.0 t -66.64 -50.33 63.3 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.811 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.4 ' HG3' ' N ' ' A' ' 89' ' ' ASP . 8.7 pt-20 -58.79 -36.0 73.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.487 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.4 ' N ' ' HG3' ' A' ' 88' ' ' GLU . 0.8 OUTLIER -70.19 -31.42 68.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.73 179.649 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.414 HD23 HD23 ' A' ' 91' ' ' LEU . 6.5 tt -66.34 -49.05 68.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.993 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.678 HD21 ' CE1' ' A' ' 34' ' ' PHE . 7.0 mt -60.71 -49.09 78.89 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.143 0.497 . . . . 0.0 109.848 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.2 m -55.73 -42.72 75.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.662 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.77 -52.25 63.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.685 179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 1.116 HD21 HG22 ' A' ' 38' ' ' VAL . 4.6 mp -57.45 -42.68 82.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.756 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.59 -43.88 76.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.611 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.7 mtmt -66.35 -29.64 69.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.031 0.443 . . . . 0.0 109.835 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.6 mttt . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.458 -179.96 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.4 p . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.769 0.319 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.455 HD23 ' HA ' ' A' ' 63' ' ' MET . 2.9 mt -54.69 -32.89 60.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.161 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.501 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.0 p -63.98 -46.5 93.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.412 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.501 ' N ' HG13 ' A' ' 22' ' ' VAL . 47.8 mttm -56.73 -50.52 71.96 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.019 0.438 . . . . 0.0 110.674 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 1.034 HG12 HG23 ' A' ' 59' ' ' ILE . 3.5 t -57.04 -39.96 69.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.116 179.499 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.1 -37.15 93.81 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.595 179.056 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.1 m -57.02 -47.28 81.28 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.078 0.466 . . . . 0.0 110.084 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.497 HD11 ' HB2' ' A' ' 83' ' ' LEU . 4.1 tt -61.53 -38.7 88.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.818 179.032 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.463 ' HB2' HG21 ' A' ' 59' ' ' ILE . 6.5 tttt -54.92 -37.8 66.84 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 178.57 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.0 -41.85 95.0 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.33 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.26 -30.48 71.62 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.795 178.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.555 HD13 ' CD1' ' A' ' 59' ' ' ILE . 0.3 OUTLIER -63.0 -52.35 63.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.101 179.312 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -57.93 -36.06 71.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.076 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.417 ' O ' HG23 ' A' ' 37' ' ' VAL . 0.1 OUTLIER -58.99 -44.55 91.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.244 179.305 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.857 ' O ' HG23 ' A' ' 38' ' ' VAL . 13.1 m-85 -61.18 -43.37 98.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.346 179.531 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.8 m-20 -54.09 -44.67 71.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.534 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -59.26 -54.32 48.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.062 0.458 . . . . 0.0 110.439 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 33' ' ' LYS . 22.4 t -55.89 -37.78 49.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.49 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.857 HG23 ' O ' ' A' ' 34' ' ' PHE . 48.8 t -69.58 -40.86 80.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.618 179.43 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.8 t -63.72 -23.29 67.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.334 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.05 -38.75 92.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.564 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.605 HD21 ' HA ' ' A' ' 38' ' ' VAL . 0.5 OUTLIER -88.81 -34.23 17.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.682 0.277 . . . . 0.0 111.23 -179.836 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.86 10.02 6.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.756 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.432 ' H ' HD12 ' A' ' 41' ' ' LEU . 5.1 t0 -103.76 103.28 13.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.78 0.324 . . . . 0.0 111.071 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.715 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 101.11 53.67 1.0 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.575 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.52 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 2.2 mmtt -66.69 -57.27 12.28 Favored Pre-proline 0 C--N 1.327 -0.388 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 13.8 Cg_endo -56.88 -49.47 14.39 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.47 2.113 . . . . 0.0 112.974 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.27 -50.14 72.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.826 0.346 . . . . 0.0 111.213 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.765 HG11 HG11 ' A' ' 38' ' ' VAL . 50.7 t -64.59 -55.57 20.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.706 179.693 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.446 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 85.3 m-20 -55.46 -25.57 37.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.092 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.32 -49.44 34.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.861 0.362 . . . . 0.0 111.585 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -76.62 -44.56 33.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.492 0.663 . . . . 0.0 109.753 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.767 ' HA ' HD12 ' A' ' 55' ' ' LEU . 1.8 mt -57.62 -35.34 50.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.337 179.096 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.504 ' HG3' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -69.4 -51.71 33.91 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.591 179.283 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.94 ' HA ' HD12 ' A' ' 57' ' ' ILE . 5.1 m120 -50.99 -34.46 29.2 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.712 0.291 . . . . 0.0 110.513 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.767 HD12 ' HA ' ' A' ' 52' ' ' ILE . 1.7 mt -75.81 -43.49 45.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.315 179.275 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.832 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -56.86 -36.41 70.01 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.551 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.94 HD12 ' HA ' ' A' ' 54' ' ' ASN . 12.2 mt -68.51 -40.73 82.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 114.937 -1.028 . . . . 0.0 109.946 178.528 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.74 ' O ' HD12 ' A' ' 62' ' ' LEU . 9.8 m -57.48 -45.62 84.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.482 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 1.034 HG23 HG12 ' A' ' 24' ' ' VAL . 4.6 mt -60.23 -50.72 79.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.398 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.436 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 72.7 m-20 -57.08 -31.68 65.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.166 179.246 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -63.25 -49.32 74.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.672 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.74 HD12 ' O ' ' A' ' 58' ' ' SER . 1.6 mp -56.16 -56.99 14.17 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.023 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.455 ' HA ' HD23 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -46.44 -50.72 16.4 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.7 0.286 . . . . 0.0 110.841 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.07 -24.44 67.7 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.753 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.9 mtpt -82.45 -29.36 30.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.113 0.482 . . . . 0.0 110.557 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.654 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -73.07 -37.13 52.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.201 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 5.5 mmmt -93.96 -27.46 16.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.542 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.767 ' O ' HG23 ' A' ' 69' ' ' THR . 1.2 t -105.67 24.96 11.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.699 0.285 . . . . 0.0 111.411 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.767 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 174.66 155.06 0.14 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.887 179.746 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 5.9 mtm -107.73 69.27 0.73 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.907 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.64 ' SD ' HD11 ' A' ' 76' ' ' ILE . 9.2 ptm -72.11 173.29 8.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.791 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.43 141.96 28.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.066 -179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.08 -29.89 67.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.714 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -58.01 -40.25 80.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.725 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -35.04 79.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.52 179.659 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.663 ' CD1' HD23 ' A' ' 62' ' ' LEU . 27.0 mm -67.96 -37.54 78.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.833 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 4.0 tp60 -66.68 -52.12 48.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.853 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -45.67 85.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.731 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -56.56 -35.13 67.81 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.912 ' O ' HG23 ' A' ' 84' ' ' VAL . 11.2 t80 -64.21 -38.08 89.76 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 177.705 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -69.97 -35.79 74.72 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.09 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.42 79.2 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.242 0.544 . . . . 0.0 109.75 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.497 ' HB2' HD11 ' A' ' 27' ' ' LEU . 6.5 mt -74.45 -31.25 62.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.045 178.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.912 HG23 ' O ' ' A' ' 80' ' ' TYR . 61.4 t -69.57 -38.99 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.356 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -66.13 -49.14 68.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.377 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 74.7 m -68.27 -38.06 81.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.407 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.437 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 24.3 m -65.7 -50.37 65.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.692 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.89 -43.58 73.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.985 0.421 . . . . 0.0 110.728 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -67.56 -29.12 68.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.707 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.494 HD23 HD23 ' A' ' 91' ' ' LEU . 6.1 tt -67.92 -48.89 64.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.064 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.617 HD21 ' CD1' ' A' ' 34' ' ' PHE . 7.0 mt -61.03 -52.44 64.94 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.057 0.456 . . . . 0.0 110.076 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.4 m -58.58 -38.32 77.66 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.662 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.25 -36.06 76.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.875 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.511 HD21 HG13 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -70.23 -42.42 72.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.856 179.904 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.01 -54.25 49.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.686 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.6 mtpp -63.78 -28.9 70.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.37 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.5 tttp . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.161 -179.968 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.583 ' OG ' HG21 ' A' ' 76' ' ' ILE . 40.2 t . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.831 0.348 . . . . 0.0 110.799 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.5 -32.73 72.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.933 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.517 HG13 ' N ' ' A' ' 23' ' ' LYS . 11.5 p -61.18 -47.98 91.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.254 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.517 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -59.45 -37.91 79.36 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.912 0.387 . . . . 0.0 110.589 179.666 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 20' ' ' SER . 19.8 t -58.67 -50.61 78.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.395 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.15 -40.45 97.23 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.644 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.644 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -57.02 -37.99 72.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.08 0.466 . . . . 0.0 110.022 179.292 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.818 HD22 HD13 ' A' ' 83' ' ' LEU . 0.7 OUTLIER -64.97 -42.83 94.23 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 178.932 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.75 -35.78 56.74 Favored 'General case' 0 C--N 1.333 -0.128 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.187 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.644 ' HG3' ' HA ' ' A' ' 26' ' ' THR . 23.2 mttt -61.69 -45.64 93.1 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.592 178.01 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -36.96 71.55 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.316 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.402 HD23 ' HB3' ' A' ' 56' ' ' GLU . 6.1 mp -61.36 -51.2 69.8 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.491 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -57.94 -37.04 73.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.296 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.434 ' O ' HG23 ' A' ' 37' ' ' VAL . 3.8 tptt -58.86 -43.2 90.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.263 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.814 ' O ' HG23 ' A' ' 38' ' ' VAL . 13.0 m-85 -63.91 -41.39 97.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.612 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 45.5 m-20 -55.19 -44.19 75.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.872 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -62.72 -54.29 41.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.766 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 33' ' ' LYS . 33.7 t -57.71 -38.22 63.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.06 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.891 HG21 HG11 ' A' ' 48' ' ' VAL . 47.9 t -75.07 -35.45 34.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.885 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.4 p -60.78 -34.02 73.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.531 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.11 -21.42 59.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.269 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' A' ' 38' ' ' VAL . 77.5 mt -71.45 -41.28 69.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.93 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.67 13.81 7.66 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.567 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -131.06 135.56 47.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.92 0.391 . . . . 0.0 110.898 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.549 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 59.05 57.27 20.73 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.488 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.498 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 3.7 mmmm -77.45 -45.09 2.62 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 120.508 0.194 . . . . 0.0 111.348 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.498 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 50.2 Cg_exo -53.68 -42.36 66.75 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.256 1.971 . . . . 0.0 112.475 -179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -60.64 -50.23 74.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.921 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.891 HG11 HG21 ' A' ' 38' ' ' VAL . 5.1 t -65.92 -55.21 20.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.082 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.6 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 97.4 m-20 -52.85 -31.11 37.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.362 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 26.4 ttm180 -73.06 -47.89 40.74 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -73.01 -41.27 64.44 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.621 0.724 . . . . 0.0 109.41 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.618 HG13 HG12 ' A' ' 48' ' ' VAL . 1.4 mt -61.87 -31.54 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.082 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.6 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -70.16 -55.05 10.35 Favored 'General case' 0 N--CA 1.46 0.055 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.366 179.54 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.961 ' HA ' HD12 ' A' ' 57' ' ' ILE . 28.5 p30 -59.83 -25.42 64.98 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.989 -179.512 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 71.9 mt -77.54 -46.74 21.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.514 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.541 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -57.0 -32.88 66.57 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.957 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.961 HD12 ' HA ' ' A' ' 54' ' ' ASN . 13.6 mt -71.4 -41.43 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.063 178.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.558 ' O ' HD12 ' A' ' 62' ' ' LEU . 69.1 m -57.46 -47.6 81.42 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.214 179.435 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.541 HD12 ' HA ' ' A' ' 56' ' ' GLU . 11.7 mt -59.78 -49.83 82.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.271 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.79 -32.58 71.92 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.114 179.265 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -57.83 -49.86 75.22 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.96 179.182 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.642 ' O ' HG12 ' A' ' 66' ' ' ILE . 0.8 OUTLIER -55.72 -53.62 54.41 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.2 178.89 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.432 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.28 -56.44 4.87 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.018 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.62 -24.07 65.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.607 179.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.07 -29.19 31.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.233 0.539 . . . . 0.0 110.415 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.642 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.8 mm -73.46 -41.11 56.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.499 -179.302 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.75 -29.51 16.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.875 -179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.765 ' O ' HG23 ' A' ' 69' ' ' THR . 0.8 OUTLIER -102.32 24.23 10.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.693 0.282 . . . . 0.0 111.713 -179.387 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.765 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 177.57 149.82 0.18 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.935 179.523 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.4 mtm -76.06 63.22 1.77 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.957 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.51 125.77 25.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.788 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.1 m -78.11 135.54 37.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.799 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.86 -33.71 50.98 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.871 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.39 -47.51 83.64 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.347 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.15 -32.92 74.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.353 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.629 ' CD1' HD23 ' A' ' 62' ' ' LEU . 26.1 mm -71.58 -38.69 68.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.695 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -52.18 66.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.634 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.58 -47.04 80.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.485 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -56.54 -34.06 66.71 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.907 ' O ' HG23 ' A' ' 84' ' ' VAL . 16.2 t80 -64.24 -37.26 86.86 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -69.67 -36.7 76.26 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.978 178.545 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.49 -36.07 75.34 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.146 0.498 . . . . 0.0 109.688 179.022 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.818 HD13 HD22 ' A' ' 27' ' ' LEU . 5.2 mt -76.74 -31.25 56.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.004 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.907 HG23 ' O ' ' A' ' 80' ' ' TYR . 54.0 t -69.55 -34.83 63.49 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.466 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.8 tptp -71.99 -49.26 38.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.408 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 11.6 m -66.71 -43.7 83.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.406 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 98.5 p -61.51 -48.46 80.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.505 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -55.28 -41.04 71.73 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.702 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.98 -34.36 78.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.602 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 tt -63.36 -46.3 87.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.791 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.765 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.3 mt -63.75 -47.47 80.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.129 0.49 . . . . 0.0 109.825 179.431 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 33.8 p -56.52 -39.51 73.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.564 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.99 -47.03 75.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.592 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 85.7 mt -57.2 -44.78 83.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.632 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.82 -39.85 86.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.368 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.4 mttt -64.22 -29.15 70.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.853 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.227 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.309 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 120.84 0.352 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.471 ' HG ' HG21 ' A' ' 66' ' ' ILE . 20.4 mt -54.01 -33.0 55.96 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.074 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.501 HG13 ' N ' ' A' ' 23' ' ' LYS . 12.3 p -60.78 -45.91 97.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.042 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.501 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -60.44 -46.81 88.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.058 0.456 . . . . 0.0 110.587 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.535 HG13 HG23 ' A' ' 59' ' ' ILE . 19.4 t -56.97 -44.78 83.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.419 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.89 -36.41 92.78 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.707 -0.759 . . . . 0.0 111.68 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.3 m -57.98 -47.51 82.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.913 0.387 . . . . 0.0 110.186 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.768 HD13 HD13 ' A' ' 83' ' ' LEU . 12.8 mt -60.84 -39.04 87.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.078 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.483 ' HA ' HD12 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -54.55 -40.62 68.88 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.589 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.57 -37.23 86.84 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.387 178.487 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.405 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -62.04 -33.4 74.3 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.726 178.979 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 1.006 HD11 HD12 ' A' ' 59' ' ' ILE . 64.4 mt -65.26 -48.86 71.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.022 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -57.75 -42.06 83.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.195 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.4 tptt -61.08 -41.93 97.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.047 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.829 ' CZ ' HD21 ' A' ' 91' ' ' LEU . 4.0 m-30 -60.73 -45.44 94.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.366 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 12.6 m-20 -58.65 -36.45 74.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.615 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -61.42 -55.29 32.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.479 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 36.6 t -58.97 -37.93 70.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.67 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.87 HG21 HG11 ' A' ' 48' ' ' VAL . 46.3 t -70.82 -37.79 70.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.871 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.56 -36.88 79.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.426 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.34 -12.77 60.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.387 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.532 HD12 ' HA ' ' A' ' 38' ' ' VAL . 52.3 mt -85.98 -55.52 3.91 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.965 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.13 3.73 4.44 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.649 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -114.09 126.64 55.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.781 0.324 . . . . 0.0 110.692 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.772 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 75.89 31.93 54.59 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.326 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.535 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 6.8 mmtt -48.1 -57.31 10.72 Favored Pre-proline 0 C--N 1.331 -0.236 0 N-CA-C 111.606 0.224 . . . . 0.0 111.606 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 10.6 Cg_endo -54.1 -49.19 17.9 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.524 2.149 . . . . 0.0 112.513 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -53.34 -49.71 66.55 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.017 0.437 . . . . 0.0 111.264 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.87 HG11 HG21 ' A' ' 38' ' ' VAL . 2.5 t -67.64 -55.23 17.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.92 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.567 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 79.5 m-20 -52.66 -35.7 55.48 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.494 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 11.6 ptt85 -73.65 -38.96 64.82 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.494 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 61.7 mt-30 -75.94 -47.75 23.95 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.731 0.777 . . . . 0.0 109.163 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.727 ' CD1' HG12 ' A' ' 48' ' ' VAL . 3.6 mt -57.03 -32.14 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 114.555 -1.202 . . . . 0.0 110.09 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.613 ' HD2' HD11 ' A' ' 57' ' ' ILE . 0.4 OUTLIER -69.13 -52.99 22.54 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.418 179.011 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.919 ' HA ' HD12 ' A' ' 57' ' ' ILE . 4.6 m120 -50.99 -34.31 28.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.875 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 51' ' ' GLN . 26.4 mt -76.0 -45.96 31.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.96 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.451 ' HG3' ' N ' ' A' ' 57' ' ' ILE . 0.4 OUTLIER -56.65 -31.91 64.83 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.915 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.919 HD12 ' HA ' ' A' ' 54' ' ' ASN . 16.8 mt -71.34 -44.79 72.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.055 178.458 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.603 ' O ' HD12 ' A' ' 62' ' ' LEU . 4.6 m -60.27 -52.41 65.39 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.355 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 1.006 HD12 HD11 ' A' ' 31' ' ' LEU . 71.6 mt -58.24 -51.43 71.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.585 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.16 -33.52 71.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.206 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -57.64 -49.49 76.28 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.962 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.657 ' O ' HG12 ' A' ' 66' ' ' ILE . 0.8 OUTLIER -55.33 -52.51 63.24 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.16 178.912 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.502 ' HE3' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -44.96 -58.55 3.08 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.02 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.24 -24.2 62.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.576 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.434 ' HA ' HG23 ' A' ' 69' ' ' THR . 0.2 OUTLIER -82.18 -29.66 31.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.141 0.496 . . . . 0.0 110.562 179.485 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.2 mm -70.49 -40.45 77.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.237 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.27 1.23 51.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.17 -179.155 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.478 ' O ' HG22 ' A' ' 69' ' ' THR . 1.5 m -132.95 21.18 4.13 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 120.748 -0.381 . . . . 0.0 112.018 -179.666 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.478 HG22 ' O ' ' A' ' 68' ' ' SER . 1.0 OUTLIER -160.34 -175.34 4.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.858 0.361 . . . . 0.0 110.833 179.32 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -126.55 33.42 4.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.392 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.1 mmm -56.91 149.98 17.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.999 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.7 m -80.67 143.94 32.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.904 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.81 -30.77 58.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.64 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -58.08 -46.26 85.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.39 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.06 -35.68 73.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.203 179.338 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.646 HG22 ' CE2' ' A' ' 80' ' ' TYR . 18.4 mm -69.54 -33.97 59.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.489 179.294 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 80' ' ' TYR . 8.0 tp-100 -61.83 -49.44 76.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.468 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 mmtt -62.59 -41.61 99.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.273 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -57.69 -36.22 71.67 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.905 ' O ' HG23 ' A' ' 84' ' ' VAL . 14.5 m-85 -64.32 -35.9 82.38 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 177.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -69.44 -37.58 77.43 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.026 178.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.46 -34.62 75.76 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.24 0.543 . . . . 0.0 109.61 178.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.768 HD13 HD13 ' A' ' 27' ' ' LEU . 54.4 mt -76.87 -30.26 56.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.06 178.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.905 HG23 ' O ' ' A' ' 80' ' ' TYR . 66.4 t -68.12 -35.76 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.41 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.7 tptt -72.44 -49.26 34.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.599 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.9 m -66.03 -43.11 88.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.518 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 96.3 p -62.38 -46.7 87.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.525 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -55.94 -41.26 74.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.634 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.96 -32.12 73.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.704 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.589 HD22 ' CD2' ' A' ' 34' ' ' PHE . 7.9 tt -63.97 -47.8 78.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.046 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.829 HD21 ' CZ ' ' A' ' 34' ' ' PHE . 7.6 mt -60.59 -52.55 64.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.109 0.481 . . . . 0.0 109.925 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 69.8 m -54.93 -38.63 67.91 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.487 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.435 ' HA ' ' HG2' ' A' ' 96' ' ' LYS . . . -68.93 -36.17 77.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.621 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.9 tp -66.29 -49.06 68.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.745 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -55.92 -48.92 74.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.613 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.435 ' HG2' ' HA ' ' A' ' 93' ' ' ALA . 9.0 pttt -62.84 -28.62 70.14 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.167 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.599 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.553 ' HB3' HG21 ' A' ' 76' ' ' ILE . 1.0 OUTLIER . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.738 0.304 . . . . 0.0 111.025 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.778 ' HG ' HG21 ' A' ' 66' ' ' ILE . 5.0 mt -53.78 -32.84 53.97 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.061 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.49 HG13 ' N ' ' A' ' 23' ' ' LYS . 11.6 p -67.8 -45.15 84.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.97 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.49 ' N ' HG13 ' A' ' 22' ' ' VAL . 2.0 tppp? -63.43 -52.98 59.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.928 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.757 HG12 HG23 ' A' ' 59' ' ' ILE . 23.7 t -56.76 -46.97 83.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.578 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -58.83 -40.22 94.84 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.511 -0.852 . . . . 0.0 111.419 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.469 HG22 ' HE ' ' A' ' 30' ' ' ARG . 48.4 m -57.18 -38.96 74.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.063 0.459 . . . . 0.0 109.925 179.008 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.702 ' CD2' HD13 ' A' ' 83' ' ' LEU . 15.8 tp -62.84 -44.06 97.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.878 179.116 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.95 -39.6 63.03 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -36.2 83.55 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.582 178.412 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.469 ' HE ' HG22 ' A' ' 26' ' ' THR . 0.0 OUTLIER -65.62 -33.61 76.3 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.876 179.024 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.726 HD13 ' CD1' ' A' ' 59' ' ' ILE . 0.7 OUTLIER -64.96 -42.02 94.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.945 179.194 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.28 -49.39 77.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.832 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.5 ' O ' HG23 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -57.86 -35.78 71.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.823 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.829 ' O ' HG23 ' A' ' 38' ' ' VAL . 15.7 m-85 -65.62 -39.87 91.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.891 0.376 . . . . 0.0 110.411 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -61.33 -40.61 94.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.379 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -53.66 54.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.363 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 33' ' ' LYS . 22.6 t -57.54 -37.96 61.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.723 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.829 HG23 ' O ' ' A' ' 34' ' ' PHE . 77.2 t -71.18 -39.41 73.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.892 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.84 -37.16 75.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.74 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.76 -17.98 65.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.426 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.63 HD12 ' HA ' ' A' ' 38' ' ' VAL . 24.4 mt -79.93 -34.64 38.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.148 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER 64.77 12.69 7.87 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.476 -179.741 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -133.82 155.28 50.11 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.814 0.34 . . . . 0.0 110.766 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.854 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 57.8 27.79 59.6 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.32 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.524 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 1.1 mmtt -55.73 -57.21 22.69 Favored Pre-proline 0 C--N 1.329 -0.306 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 11.7 Cg_endo -55.69 -49.09 16.96 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.428 2.085 . . . . 0.0 112.68 -179.649 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 4.2 mt-10 -55.49 -48.95 73.78 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.069 0.461 . . . . 0.0 111.074 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.854 HG23 ' O ' ' A' ' 44' ' ' GLY . 18.8 t -67.19 -50.06 66.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.256 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.416 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 86.0 m-20 -59.06 -33.09 70.38 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.493 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 8.1 ptp180 -73.51 -40.21 64.21 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.442 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.493 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 31.7 mt-30 -75.98 -49.77 16.74 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.05 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.591 HG13 ' O ' ' A' ' 48' ' ' VAL . 2.0 mt -56.89 -29.91 32.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.005 178.537 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.473 ' HA ' ' HG2' ' A' ' 56' ' ' GLU . 32.2 tttt -69.26 -53.17 21.16 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.159 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.933 ' HA ' HD12 ' A' ' 57' ' ' ILE . 3.6 m120 -53.17 -32.39 47.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.843 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.563 ' HB2' HD21 ' A' ' 31' ' ' LEU . 55.6 mt -74.51 -47.82 30.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.305 -179.808 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.473 ' HG2' ' HA ' ' A' ' 53' ' ' LYS . 3.5 pt-20 -56.21 -31.79 63.8 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.933 HD12 ' HA ' ' A' ' 54' ' ' ASN . 15.6 mt -71.04 -43.26 76.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.897 178.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.825 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.5 m -58.48 -46.96 85.57 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.255 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.757 HG23 HG12 ' A' ' 24' ' ' VAL . 55.5 mt -60.08 -55.56 23.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.458 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.2 -34.12 68.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.245 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -56.8 -49.17 76.14 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.197 0.522 . . . . 0.0 109.899 179.146 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.825 HD12 ' O ' ' A' ' 58' ' ' SER . 1.2 mp -55.09 -48.77 73.1 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.867 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.409 ' CE ' ' HB ' ' A' ' 24' ' ' VAL . 12.5 mmt -44.85 -59.84 2.34 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.764 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.94 -23.58 61.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.589 179.302 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.405 ' O ' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -82.03 -29.0 32.19 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.293 0.568 . . . . 0.0 110.538 179.37 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.778 HG21 ' HG ' ' A' ' 21' ' ' LEU . 2.3 mm -73.41 -45.7 51.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.913 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.3 -32.43 17.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.013 -178.802 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.806 ' O ' HG23 ' A' ' 69' ' ' THR . 0.3 OUTLIER -98.08 22.18 9.78 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.233 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.806 HG23 ' O ' ' A' ' 68' ' ' SER . 0.6 OUTLIER 179.36 149.75 0.29 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.817 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -78.9 61.2 3.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.951 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.07 120.59 10.57 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.806 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.2 m -65.32 132.71 49.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.774 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.34 -31.51 54.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.83 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -61.33 -45.75 93.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.437 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.42 -33.72 75.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.424 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.625 ' CD1' HD23 ' A' ' 62' ' ' LEU . 20.9 mm -68.53 -33.88 62.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.787 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -67.8 -48.69 65.58 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.856 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -49.02 70.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.578 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -56.61 -33.54 66.35 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 178.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.824 ' O ' HG23 ' A' ' 84' ' ' VAL . 54.8 t80 -64.89 -35.62 81.73 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 177.602 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -69.54 -37.05 76.92 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.93 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.5 -35.38 75.8 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 121.28 0.562 . . . . 0.0 109.633 178.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.702 HD13 ' CD2' ' A' ' 27' ' ' LEU . 7.1 mt -75.51 -31.57 60.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.082 178.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.824 HG23 ' O ' ' A' ' 80' ' ' TYR . 75.6 t -67.71 -34.64 69.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.386 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? -72.15 -49.42 36.01 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.277 179.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 69.6 m -63.4 -41.67 98.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.18 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.1 t -62.94 -50.0 72.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.321 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -50.59 -42.37 55.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.564 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -70.64 -29.17 65.46 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.636 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.566 HD11 HG12 ' A' ' 52' ' ' ILE . 7.0 tt -67.86 -49.23 63.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.948 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.45 ' CD2' ' CE1' ' A' ' 34' ' ' PHE . 6.8 mt -61.78 -46.64 88.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.128 0.49 . . . . 0.0 109.797 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 12.1 p -54.94 -42.52 72.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.452 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.84 -47.33 81.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.348 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.495 ' CD2' HG22 ' A' ' 38' ' ' VAL . 4.2 mt -59.03 -45.15 91.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.439 179.481 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -55.83 -39.39 71.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.333 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.12 -30.84 70.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.818 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 43.6 mttt . . . . . 0 C--N 1.331 -0.201 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.958 179.727 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.441 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.1 p . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.884 0.373 . . . . 0.0 110.945 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.489 ' HG ' HG21 ' A' ' 66' ' ' ILE . 30.0 mt -60.14 -32.86 71.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.86 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 40.4 t -59.83 -52.33 62.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.096 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -53.76 -46.41 70.92 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.009 0.433 . . . . 0.0 110.657 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.487 ' CG1' ' HE3' ' A' ' 63' ' ' MET . 10.7 t -59.45 -43.24 90.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.436 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.93 -36.26 91.84 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.604 -0.808 . . . . 0.0 111.763 179.183 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -49.06 76.98 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.98 0.419 . . . . 0.0 110.218 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.97 HD13 HD13 ' A' ' 83' ' ' LEU . 6.6 mt -62.16 -38.8 90.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.945 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.522 ' HG2' HG21 ' A' ' 59' ' ' ILE . 0.4 OUTLIER -53.68 -37.79 63.56 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.757 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.42 -40.53 81.17 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.793 178.639 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -62.54 -36.91 84.11 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.046 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.443 HD11 ' HB2' ' A' ' 55' ' ' LEU . 3.3 mm? -62.61 -48.42 79.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.256 179.418 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -59.99 -35.07 74.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.361 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -60.59 -46.08 91.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.341 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.825 ' O ' HG23 ' A' ' 38' ' ' VAL . 18.9 m-85 -62.59 -41.16 98.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.415 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -57.84 -38.22 75.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.885 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.11 -54.39 30.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.554 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 29.1 t -58.33 -38.24 68.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.779 179.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.825 HG23 ' O ' ' A' ' 34' ' ' PHE . 45.2 t -74.99 -35.83 36.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.882 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.1 m -59.91 -34.88 73.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.633 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.55 -16.44 60.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.301 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.643 HD12 ' HA ' ' A' ' 38' ' ' VAL . 82.6 mt -75.51 -45.97 35.07 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.127 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 1.4 mptt 68.31 8.43 6.6 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.53 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -127.38 150.15 49.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.716 0.293 . . . . 0.0 110.684 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.63 ' O ' HG12 ' A' ' 48' ' ' VAL . . . 57.16 34.03 65.98 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.267 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.513 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 3.8 mmtp -63.01 -44.3 84.49 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.423 0.154 . . . . 0.0 111.389 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.513 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 32.2 Cg_exo -58.78 -49.18 12.22 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.495 2.13 . . . . 0.0 112.864 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -64.59 -50.09 68.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.734 0.302 . . . . 0.0 111.704 -179.299 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.77 HG11 HG11 ' A' ' 38' ' ' VAL . 14.7 p -66.88 -46.75 84.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.186 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.482 ' N ' HG13 ' A' ' 48' ' ' VAL . 95.7 m-20 -60.24 -28.98 68.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.833 0.349 . . . . 0.0 110.759 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 20.9 ttt-85 -74.16 -47.11 38.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.42 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.402 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 14.4 pt20 -72.37 -46.15 56.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.607 0.717 . . . . 0.0 109.268 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.612 HG13 HG22 ' A' ' 48' ' ' VAL . 1.2 mt -57.48 -39.45 68.97 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-N 114.646 -1.161 . . . . 0.0 110.459 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.452 ' O ' HG12 ' A' ' 57' ' ' ILE . 1.2 tmtt? -64.34 -47.78 78.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.592 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.494 ' HA ' HG12 ' A' ' 57' ' ' ILE . 14.2 m-20 -51.5 -49.18 62.37 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.707 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.443 ' HB2' HD11 ' A' ' 31' ' ' LEU . 14.2 mt -58.98 -40.73 85.7 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.493 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -56.99 -29.68 63.48 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.164 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.494 HG12 ' HA ' ' A' ' 54' ' ' ASN . 5.3 mm -71.19 -43.52 74.81 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.236 178.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.861 ' O ' HD12 ' A' ' 62' ' ' LEU . 28.3 t -57.94 -52.98 63.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.666 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.522 HG21 ' HG2' ' A' ' 28' ' ' LYS . 3.4 mt -58.38 -52.79 54.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.943 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.53 -36.47 71.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.492 179.633 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.99 -49.31 76.15 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.37 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.861 HD12 ' O ' ' A' ' 58' ' ' SER . 1.7 mp -55.21 -52.51 63.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.537 179.327 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.487 ' HE3' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.03 -55.93 5.12 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.131 179.853 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.53 -24.28 66.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.65 179.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.3 mtpt -82.06 -29.06 32.06 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-O 121.135 0.493 . . . . 0.0 110.488 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.659 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.1 mm -71.64 -39.5 69.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.225 -179.399 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -93.11 -28.28 16.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.695 -179.283 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.773 ' O ' HG23 ' A' ' 69' ' ' THR . 0.3 OUTLIER -103.73 24.25 11.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.759 0.314 . . . . 0.0 111.753 -179.553 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.773 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 176.92 150.09 0.15 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.057 179.488 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 1.9 mpp? -76.01 69.69 2.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.991 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.57 125.65 27.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.774 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.65 142.89 33.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.794 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.66 -35.12 60.68 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.938 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -59.28 -47.3 85.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.682 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -59.92 -32.48 70.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.465 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.602 ' CD1' HD23 ' A' ' 62' ' ' LEU . 26.9 mm -72.0 -34.27 50.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.702 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.22 -46.04 85.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.684 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -49.24 66.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.549 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.539 ' O ' HD12 ' A' ' 83' ' ' LEU . 2.4 mt-10 -56.5 -34.35 66.89 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.811 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.899 ' O ' HG23 ' A' ' 84' ' ' VAL . 16.9 t80 -64.73 -35.34 80.73 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 177.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -69.26 -37.52 77.98 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.954 178.562 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.19 -36.9 78.66 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 178.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.97 HD13 HD13 ' A' ' 27' ' ' LEU . 1.2 mt -75.48 -30.48 59.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.948 178.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.899 HG23 ' O ' ' A' ' 80' ' ' TYR . 93.2 t -67.88 -35.0 70.65 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.288 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.02 -49.38 37.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.206 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.9 -34.7 79.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.129 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.414 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 3.2 m -65.25 -46.35 80.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.286 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -56.36 -44.93 80.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.593 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -65.56 -30.68 71.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.689 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.569 HD23 ' C ' ' A' ' 90' ' ' LEU . 6.3 tt -64.26 -49.2 72.8 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.875 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.446 HD23 ' CD2' ' A' ' 90' ' ' LEU . 5.7 mt -60.67 -44.27 96.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.206 0.527 . . . . 0.0 110.018 179.664 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.52 -40.22 71.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.95 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.22 -53.7 34.01 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.083 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.418 HD13 HG22 ' A' ' 38' ' ' VAL . 67.2 mt -60.07 -38.17 82.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.736 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -54.2 48.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.909 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -56.42 -38.89 72.19 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.029 0.442 . . . . 0.0 110.314 179.573 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.886 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.675 ' HB3' HG21 ' A' ' 76' ' ' ILE . 0.5 OUTLIER . . . . . 0 CA--C 1.53 0.206 0 CA-C-O 120.67 0.271 . . . . 0.0 111.098 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.7 mt -54.05 -32.83 55.74 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.098 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.524 HG13 ' N ' ' A' ' 23' ' ' LYS . 9.1 p -65.79 -47.84 84.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.251 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.524 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -59.42 -53.35 59.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.167 0.508 . . . . 0.0 110.519 179.726 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 1.052 HG12 HG23 ' A' ' 59' ' ' ILE . 3.8 t -56.79 -39.04 61.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.058 179.132 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -63.75 -37.29 94.47 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.596 -0.811 . . . . 0.0 111.158 178.689 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.5 m -57.09 -44.85 83.57 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 178.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.647 HD13 HD13 ' A' ' 83' ' ' LEU . 0.5 OUTLIER -61.75 -37.75 85.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.701 178.762 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.74 -40.33 69.2 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.556 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.82 -37.84 88.96 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.25 178.428 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.58 -34.31 77.54 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.861 179.066 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.818 HD22 HG23 ' A' ' 52' ' ' ILE . 9.4 mt -62.59 -50.26 71.98 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.958 179.275 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -57.81 -38.24 75.2 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.218 179.164 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.4 tptt -57.68 -44.56 85.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.295 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.818 ' O ' HG23 ' A' ' 38' ' ' VAL . 4.7 m-85 -61.22 -39.86 91.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.083 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -56.36 -43.72 79.42 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.355 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -59.9 -54.47 45.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.505 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.8 t -56.42 -37.88 53.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.687 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.974 HG21 HG11 ' A' ' 48' ' ' VAL . 60.5 t -71.79 -37.68 63.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.816 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 t -58.01 -37.25 73.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.36 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.47 -20.45 60.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.035 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.513 HD11 ' HB3' ' A' ' 94' ' ' LEU . 43.2 mt -81.73 -28.42 33.38 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.953 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.5 -75.18 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.999 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -57.82 157.04 7.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.998 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.436 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 58.57 54.78 34.96 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.512 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.44 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -87.19 -49.68 0.46 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.578 0.228 . . . . 0.0 111.324 -179.737 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 52.5 Cg_exo -53.38 -41.88 69.64 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.556 2.17 . . . . 0.0 112.647 -179.481 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -56.62 -50.36 72.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.967 0.413 . . . . 0.0 110.888 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.974 HG11 HG21 ' A' ' 38' ' ' VAL . 2.1 t -64.34 -56.13 17.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.613 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 49.0 m-80 -54.82 -25.44 28.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.07 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.16 -48.65 41.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.851 0.357 . . . . 0.0 111.5 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -77.19 -45.3 27.11 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-O 121.409 0.623 . . . . 0.0 109.815 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.826 ' CD1' HG12 ' A' ' 48' ' ' VAL . 4.0 mt -57.77 -35.73 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.592 179.039 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.487 ' O ' HG12 ' A' ' 57' ' ' ILE . 2.9 tmtm? -69.88 -54.25 14.32 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.329 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.526 ' HA ' HG12 ' A' ' 57' ' ' ILE . 27.2 p30 -60.74 -30.77 70.2 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.524 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.602 HD22 HD23 ' A' ' 83' ' ' LEU . 75.2 mt -72.02 -38.94 69.49 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.23 -31.13 68.77 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.526 HG12 ' HA ' ' A' ' 54' ' ' ASN . 4.8 mm -68.09 -43.64 85.1 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.294 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.691 178.505 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.767 ' O ' HD12 ' A' ' 62' ' ' LEU . 5.1 t -58.56 -51.34 70.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.341 179.417 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 1.052 HG23 HG12 ' A' ' 24' ' ' VAL . 57.3 mt -61.69 -53.4 48.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.658 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.435 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 0.4 OUTLIER -55.17 -32.7 62.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.293 179.434 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.14 -49.23 75.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.761 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.767 HD12 ' O ' ' A' ' 58' ' ' SER . 0.9 OUTLIER -56.4 -57.3 12.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.069 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.53 ' SD ' HG22 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -46.0 -53.38 10.17 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.241 0.338 . . . . 0.0 110.967 -179.882 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.92 -24.48 66.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.923 0.392 . . . . 0.0 110.863 179.469 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.0 mtpt -82.61 -29.21 30.3 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.196 0.522 . . . . 0.0 110.652 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.643 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.6 mm -73.02 -35.59 48.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.132 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.62 -26.34 15.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.578 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.805 ' O ' HG23 ' A' ' 69' ' ' THR . 1.1 m -106.44 22.11 16.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.703 0.287 . . . . 0.0 111.705 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.805 HG23 ' O ' ' A' ' 68' ' ' SER . 0.6 OUTLIER 177.74 155.86 0.35 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.836 179.568 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 9.2 mtp -82.59 72.48 9.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.818 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.4 mmm -68.71 134.13 49.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.96 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.59 138.84 33.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.731 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.18 -31.57 53.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.911 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.82 -43.34 98.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.641 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -68.08 -31.5 71.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.685 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.675 HG21 ' HB3' ' A' ' 20' ' ' SER . 29.7 mm -71.82 -38.08 64.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.869 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -52.07 56.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.899 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.74 -48.85 79.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.721 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -56.35 -32.6 64.86 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 178.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.908 ' O ' HG23 ' A' ' 84' ' ' VAL . 1.9 t80 -64.65 -35.9 82.53 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 177.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -69.57 -37.66 77.06 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.057 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.05 -36.08 76.52 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 121.186 0.517 . . . . 0.0 109.678 178.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.647 HD13 HD13 ' A' ' 27' ' ' LEU . 3.0 mt -76.2 -30.54 58.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.004 178.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.908 HG23 ' O ' ' A' ' 80' ' ' TYR . 60.9 t -68.97 -35.84 71.09 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.457 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.01 -49.24 38.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.086 0.469 . . . . 0.0 110.322 179.52 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.1 p -65.01 -41.6 95.19 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.212 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.5 m -64.54 -50.17 68.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.587 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -51.97 -41.99 62.56 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.676 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.96 -30.64 68.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.723 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 tt -64.91 -48.98 72.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.431 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.9 mt -62.06 -49.57 75.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.068 0.461 . . . . 0.0 109.977 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.4 m -56.49 -30.7 63.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.72 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.49 ' HA ' ' HG2' ' A' ' 96' ' ' LYS . . . -69.88 -53.28 18.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.159 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.513 ' HB3' HD11 ' A' ' 41' ' ' LEU . 2.8 mt -61.87 -45.61 93.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.044 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -62.11 -44.93 95.58 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.207 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.49 ' HG2' ' HA ' ' A' ' 93' ' ' ALA . 1.3 pttm -61.68 -29.49 70.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.936 0.398 . . . . 0.0 110.184 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.9 mtmm . . . . . 0 C--N 1.332 -0.181 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.109 179.683 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.744 0.307 . . . . 0.0 110.78 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.562 ' HG ' HG21 ' A' ' 66' ' ' ILE . 10.4 mt -55.88 -32.94 64.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.046 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.495 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.6 p -63.84 -45.75 96.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.013 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.495 ' N ' HG13 ' A' ' 22' ' ' VAL . 21.1 mttt -60.3 -49.27 78.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.094 0.473 . . . . 0.0 110.48 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.458 ' CG1' HG23 ' A' ' 59' ' ' ILE . 21.6 t -56.96 -43.48 80.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.403 179.491 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.02 -38.05 95.44 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.645 -0.788 . . . . 0.0 111.452 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.2 m -56.76 -45.63 81.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.084 0.468 . . . . 0.0 109.938 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.85 ' CD2' HD13 ' A' ' 83' ' ' LEU . 8.6 tp -61.91 -38.37 88.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.895 179.119 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -41.22 67.94 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 178.527 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -65.06 -37.93 89.18 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.471 178.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.02 -33.39 75.94 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.929 178.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.782 HD12 HD12 ' A' ' 59' ' ' ILE . 5.1 mt -62.17 -51.91 65.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.166 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -57.91 -36.78 72.93 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.211 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.456 ' O ' HG23 ' A' ' 37' ' ' VAL . 22.1 tptt -58.61 -43.97 89.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.469 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.826 ' O ' HG23 ' A' ' 38' ' ' VAL . 16.2 m-85 -62.72 -42.56 99.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.424 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -54.13 -45.64 71.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.838 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -55.27 32.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.895 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 33' ' ' LYS . 31.5 t -55.94 -38.69 53.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.914 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.858 HG11 HG11 ' A' ' 48' ' ' VAL . 46.6 t -75.19 -33.81 29.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.75 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.0 t -61.2 -33.29 73.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.512 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.2 -29.95 67.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.779 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.55 79.92 1.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.797 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.45 -27.9 2.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.396 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -56.38 107.39 0.37 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.967 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.586 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 80.89 54.59 3.58 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.321 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.491 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -82.61 -45.97 0.92 Allowed Pre-proline 0 C--N 1.329 -0.301 0 N-CA-C 111.44 0.163 . . . . 0.0 111.44 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 52.7 Cg_exo -53.19 -43.75 54.61 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.296 1.998 . . . . 0.0 112.424 -179.546 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -58.37 -49.53 76.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.941 0.401 . . . . 0.0 110.622 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.858 HG11 HG11 ' A' ' 38' ' ' VAL . 4.9 t -60.86 -54.93 28.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.74 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.429 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 6.5 m120 -54.02 -25.73 22.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.032 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.83 -51.74 20.96 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.955 0.407 . . . . 0.0 111.52 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -73.26 -45.41 55.95 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.469 0.652 . . . . 0.0 109.276 179.548 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.652 HG13 HG12 ' A' ' 48' ' ' VAL . 1.4 mt -57.51 -31.95 40.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.312 178.846 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 25.6 tttt -69.32 -52.41 27.59 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.475 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.914 ' HA ' HD12 ' A' ' 57' ' ' ILE . 5.5 m120 -51.14 -41.68 60.25 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.834 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.8 mp -68.86 -42.98 76.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.256 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.402 ' HA ' ' CD1' ' A' ' 31' ' ' LEU . 0.5 OUTLIER -56.75 -36.6 69.95 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 178.579 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.914 HD12 ' HA ' ' A' ' 54' ' ' ASN . 11.8 mt -71.31 -42.43 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.329 178.779 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.855 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.1 m -59.73 -54.97 40.12 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.722 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.782 HD12 HD12 ' A' ' 31' ' ' LEU . 45.6 mt -58.5 -53.94 39.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.879 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.9 -34.39 67.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.578 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.58 -49.62 76.8 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.244 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.855 HD12 ' O ' ' A' ' 58' ' ' SER . 2.1 mp -55.53 -54.73 40.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.463 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.45 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -44.86 -57.0 4.04 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.19 -179.839 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.06 -24.8 64.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.832 0.348 . . . . 0.0 110.599 179.388 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.488 ' HA ' HG23 ' A' ' 69' ' ' THR . 15.7 mtpt -81.96 -29.76 32.02 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.624 179.437 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -71.88 -33.76 49.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.076 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 21.2 mmmt -93.82 -2.51 53.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.273 -179.112 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.515 ' O ' HG22 ' A' ' 69' ' ' THR . 13.0 m -140.17 19.87 2.43 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.515 HG22 ' O ' ' A' ' 68' ' ' SER . 0.4 OUTLIER -161.64 161.72 29.68 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.495 179.281 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -95.23 45.65 1.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.028 0.442 . . . . 0.0 110.58 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.84 130.43 29.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.215 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.6 m -80.08 142.38 34.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.747 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -30.52 59.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.74 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -47.25 86.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.434 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -64.31 -32.82 74.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.434 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.653 ' CD1' HD23 ' A' ' 62' ' ' LEU . 25.4 mm -70.59 -36.81 67.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.742 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -63.32 -52.21 62.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.77 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.8 tptt -62.18 -46.62 88.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.561 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -56.45 -33.31 65.77 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.7 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.902 ' O ' HG23 ' A' ' 84' ' ' VAL . 2.1 t80 -64.35 -37.5 87.74 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 177.727 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.86 -36.54 75.6 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.977 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.45 -36.07 75.24 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.247 0.546 . . . . 0.0 109.794 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.85 HD13 ' CD2' ' A' ' 27' ' ' LEU . 2.7 mt -76.74 -31.18 56.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.032 179.019 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.902 HG23 ' O ' ' A' ' 80' ' ' TYR . 47.7 t -69.83 -35.14 63.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.617 179.443 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -72.21 -49.46 35.22 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.447 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.4 m -66.03 -40.33 90.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.435 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.417 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 28.4 t -64.89 -50.06 68.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.607 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -52.84 -44.43 66.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.842 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -69.41 -27.68 65.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.82 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.594 HD11 HG12 ' A' ' 52' ' ' ILE . 7.3 tt -67.73 -49.22 63.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.067 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.9 mt -62.3 -49.11 76.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.175 0.512 . . . . 0.0 109.863 179.573 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.3 m -55.42 -37.65 67.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.46 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.4 -40.28 74.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.827 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.575 ' CD2' HG22 ' A' ' 38' ' ' VAL . 10.6 tp -62.64 -51.8 65.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -55.91 -50.53 70.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.618 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -58.81 -28.98 66.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.128 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.8 tttm . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.611 179.517 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.669 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.9 p . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.795 0.331 . . . . 0.0 110.838 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.517 ' HG ' HG21 ' A' ' 66' ' ' ILE . 3.4 mp -64.38 -32.64 74.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.029 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 32.4 t -62.5 -52.78 55.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.291 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.2 tptt -54.17 -45.22 72.04 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.919 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.779 HG12 HG23 ' A' ' 59' ' ' ILE . 11.5 t -56.73 -49.15 79.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.296 179.551 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.9 -40.07 98.37 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.554 -0.831 . . . . 0.0 111.559 178.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.808 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.1 OUTLIER -56.71 -42.32 78.97 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.253 0.549 . . . . 0.0 109.716 179.269 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.65 HD13 HD13 ' A' ' 83' ' ' LEU . 0.8 OUTLIER -59.91 -39.63 86.09 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.181 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -53.88 -35.02 61.14 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.715 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.808 ' HG3' ' HA ' ' A' ' 26' ' ' THR . 2.6 mmtt -60.17 -48.26 82.48 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.366 -0.833 . . . . 0.0 109.14 177.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.94 -33.86 62.66 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.402 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.542 HD13 HD11 ' A' ' 59' ' ' ILE . 1.4 mp -63.47 -49.74 72.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.244 179.324 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.67 -32.91 70.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.324 179.332 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 tppt? -61.91 -45.93 91.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.284 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.792 ' O ' HG23 ' A' ' 38' ' ' VAL . 8.5 m-85 -60.09 -50.17 74.77 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.659 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -54.22 -38.6 65.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.918 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -51.71 68.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.014 0.435 . . . . 0.0 110.599 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.451 HG12 HD23 ' A' ' 41' ' ' LEU . 30.7 t -62.67 -37.85 80.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.736 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 1.034 HG22 HD21 ' A' ' 94' ' ' LEU . 59.9 t -63.07 -36.22 74.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.954 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.5 m -75.83 -29.22 58.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.926 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.22 -29.21 38.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.376 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.51 ' C ' HD12 ' A' ' 41' ' ' LEU . 3.6 pp -93.4 -35.94 12.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.999 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.49 ' N ' HD12 ' A' ' 41' ' ' LEU . 1.3 mptt 58.41 102.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.97 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 174.9 122.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.729 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.633 ' O ' HG12 ' A' ' 48' ' ' VAL . . . 58.14 68.09 1.87 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.477 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.468 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -69.5 -47.59 25.87 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 111.553 0.205 . . . . 0.0 111.553 -179.705 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.468 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 35.8 Cg_exo -60.52 -49.38 9.04 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.504 2.136 . . . . 0.0 113.07 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 2.0 pm0 -58.21 -50.03 74.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.845 0.355 . . . . 0.0 111.649 -179.135 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.755 HG11 HG11 ' A' ' 38' ' ' VAL . 14.6 p -72.66 -46.55 53.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.343 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.483 ' N ' HG13 ' A' ' 48' ' ' VAL . 98.9 m-20 -59.43 -39.0 82.14 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.992 -0.283 . . . . 0.0 111.528 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.423 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 27.8 ptt180 -71.48 -41.85 68.83 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -179.422 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.404 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 28.9 mt-30 -71.78 -46.87 56.94 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 179.187 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.641 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.1 mt -57.33 -30.0 34.43 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.059 178.585 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.499 ' HD3' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -69.07 -51.15 41.72 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.342 179.035 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.911 ' HA ' HD12 ' A' ' 57' ' ' ILE . 5.0 m120 -51.5 -41.44 60.99 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.601 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 26.3 mt -67.41 -43.83 80.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.219 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.486 ' N ' HD21 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -56.74 -37.56 71.17 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.515 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.911 HD12 ' HA ' ' A' ' 54' ' ' ASN . 9.7 mt -71.26 -40.76 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.134 178.557 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.841 ' O ' HD12 ' A' ' 62' ' ' LEU . 39.9 t -57.83 -53.01 63.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.477 179.538 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.779 HG23 HG12 ' A' ' 24' ' ' VAL . 4.4 mt -60.39 -52.98 55.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.568 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.77 -33.67 68.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.465 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.84 -49.36 78.01 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.271 179.406 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.841 HD12 ' O ' ' A' ' 58' ' ' SER . 1.2 mp -55.42 -55.1 35.6 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.703 179.448 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.426 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -44.93 -58.54 3.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.164 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.49 -23.8 63.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.683 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.512 ' HA ' HG23 ' A' ' 69' ' ' THR . 1.0 OUTLIER -82.48 -29.79 30.34 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.545 179.511 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.662 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.9 mm -71.63 -35.78 57.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.236 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.7 mmmt -96.07 1.41 52.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.347 -179.061 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.488 ' O ' HG22 ' A' ' 69' ' ' THR . 19.5 m -141.93 23.33 2.07 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.512 HG23 ' HA ' ' A' ' 65' ' ' LYS . 0.7 OUTLIER -160.39 174.03 14.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.924 0.392 . . . . 0.0 110.756 179.239 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.17 38.2 2.27 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.643 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.0 mmm -55.52 141.3 37.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.059 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.3 m -84.9 145.25 27.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.754 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.4 -31.46 61.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.755 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.11 -37.9 84.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.394 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -68.59 -32.57 72.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.515 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.6 ' CD1' HD23 ' A' ' 62' ' ' LEU . 25.6 mm -72.51 -34.48 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.717 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.02 -50.72 61.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.66 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.9 -46.3 88.47 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.5 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -56.45 -34.22 66.64 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.913 ' O ' HG23 ' A' ' 84' ' ' VAL . 3.3 t80 -64.15 -37.06 86.11 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 177.609 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.43 -36.89 77.1 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.938 178.635 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.59 -36.33 76.06 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.126 0.488 . . . . 0.0 109.687 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.65 HD13 HD13 ' A' ' 27' ' ' LEU . 4.7 mt -76.43 -32.42 58.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.917 178.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.913 HG23 ' O ' ' A' ' 80' ' ' TYR . 58.9 t -67.95 -34.3 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.428 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -48.81 39.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.357 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.14 -38.51 91.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.574 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.444 ' HB2' ' CZ ' ' A' ' 34' ' ' PHE . 25.6 p -66.13 -46.49 77.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.596 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.81 -44.21 73.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.972 0.415 . . . . 0.0 110.559 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -67.93 -30.57 69.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.681 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.598 HD11 HD11 ' A' ' 52' ' ' ILE . 7.6 tt -62.77 -47.75 82.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.739 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.666 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.8 mt -62.41 -49.19 76.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.124 0.488 . . . . 0.0 109.708 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 24.1 m -57.1 -40.34 76.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.473 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.73 -51.71 46.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.712 179.568 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 1.034 HD21 HG22 ' A' ' 38' ' ' VAL . 1.2 mp -53.48 -51.6 62.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.794 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -55.67 -40.27 72.06 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.089 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.05 -53.28 60.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.61 179.351 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.4 mttt . . . . . 0 C--N 1.326 -0.44 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.196 -179.802 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.694 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.4 m . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.857 0.361 . . . . 0.0 110.911 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.457 HD21 ' HB ' ' A' ' 66' ' ' ILE . 1.1 mt -66.13 -32.89 74.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.014 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.529 HG13 ' N ' ' A' ' 23' ' ' LYS . 9.1 p -60.63 -49.42 84.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.358 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.529 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -64.32 -46.4 83.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.852 0.358 . . . . 0.0 110.648 179.8 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.694 HG23 ' O ' ' A' ' 20' ' ' SER . 44.4 t -56.84 -40.68 72.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.203 179.274 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.14 -41.98 96.72 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.646 -0.787 . . . . 0.0 111.424 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.606 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -57.97 -33.26 68.68 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.133 0.492 . . . . 0.0 109.998 179.2 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.887 ' CD2' HD13 ' A' ' 83' ' ' LEU . 13.6 tp -67.98 -45.49 73.98 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.754 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.0 mttm -52.8 -33.67 50.04 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.606 ' HG3' ' HA ' ' A' ' 26' ' ' THR . 15.7 mttt -63.52 -47.27 82.35 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.831 178.321 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.453 ' HG2' ' CZ ' ' A' ' 34' ' ' PHE . 63.1 ttt180 -61.34 -32.28 72.16 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.409 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.446 HD23 ' HG2' ' A' ' 56' ' ' GLU . 4.2 mp -62.47 -50.6 70.81 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.268 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -58.03 -37.64 74.74 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.12 0.486 . . . . 0.0 109.915 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.423 ' O ' HG23 ' A' ' 37' ' ' VAL . 24.7 tptt -57.75 -42.83 84.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.061 179.205 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.854 ' O ' HG23 ' A' ' 38' ' ' VAL . 18.9 m-30 -62.5 -42.46 99.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.254 179.45 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -53.19 -46.14 68.88 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.649 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -59.98 -54.32 47.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.505 179.536 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 33' ' ' LYS . 35.8 t -56.05 -37.86 50.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.559 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.939 HG11 HG11 ' A' ' 48' ' ' VAL . 44.5 t -74.09 -33.53 35.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.583 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.3 t -61.76 -32.93 73.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.313 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.28 -27.44 56.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.212 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.657 HD11 ' HB3' ' A' ' 94' ' ' LEU . 18.7 mt -59.78 -45.76 91.29 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.929 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 63.61 14.7 8.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.487 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -133.55 134.14 42.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.849 0.357 . . . . 0.0 110.9 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.551 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 59.0 69.81 1.17 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.487 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.528 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 2.0 mmpm? -82.93 -42.99 0.88 Allowed Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.1 Cg_exo -53.6 -49.0 18.85 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.301 2.0 . . . . 0.0 112.374 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.436 ' HA ' ' HG2' ' A' ' 50' ' ' ARG . 0.9 OUTLIER -55.6 -46.93 77.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.011 0.434 . . . . 0.0 111.076 179.969 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.939 HG11 HG11 ' A' ' 38' ' ' VAL . 11.8 t -65.83 -55.69 18.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.136 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -53.43 -34.9 59.59 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -179.499 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.448 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 5.3 ptp85 -74.37 -35.23 63.53 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -179.365 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.448 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 26.2 mt-30 -80.71 -47.56 13.81 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.554 0.692 . . . . 0.0 109.531 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.624 HG13 ' O ' ' A' ' 48' ' ' VAL . 2.6 mt -60.23 -33.67 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.101 178.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.03 -54.13 14.53 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.265 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.96 ' HA ' HD12 ' A' ' 57' ' ' ILE . 26.8 p30 -59.01 -25.48 63.69 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.738 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.547 HD22 HD23 ' A' ' 83' ' ' LEU . 84.6 mt -79.27 -44.44 21.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.356 . . . . 0.0 110.102 178.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.446 ' HG2' HD23 ' A' ' 31' ' ' LEU . 1.8 tm-20 -56.71 -35.67 68.8 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.451 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.96 HD12 ' HA ' ' A' ' 54' ' ' ASN . 12.0 mt -70.54 -41.88 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.127 178.691 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.69 ' O ' HD12 ' A' ' 62' ' ' LEU . 24.2 m -58.69 -55.14 38.91 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.472 179.569 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.562 HG12 HD23 ' A' ' 27' ' ' LEU . 4.0 mt -60.61 -52.51 60.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.63 179.519 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -58.48 -34.1 70.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.505 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.33 -49.63 76.51 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.024 0.44 . . . . 0.0 110.023 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.69 HD12 ' O ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -55.61 -52.81 62.52 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.277 178.967 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.497 ' HE2' HG11 ' A' ' 24' ' ' VAL . 17.7 tpp -45.02 -57.92 3.52 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.211 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.9 -24.2 64.1 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.619 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.469 ' HA ' HG23 ' A' ' 69' ' ' THR . 2.8 mtmp? -81.97 -29.78 31.98 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.539 179.357 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.655 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.8 mm -71.63 -36.38 59.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.095 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt -96.18 1.23 52.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.945 -0.571 . . . . 0.0 112.265 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.49 ' O ' HG22 ' A' ' 69' ' ' THR . 3.0 t -138.46 20.49 2.74 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.49 HG22 ' O ' ' A' ' 68' ' ' SER . 0.7 OUTLIER -160.84 177.08 10.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.888 0.375 . . . . 0.0 110.649 179.405 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.3 ttt -109.21 41.39 1.64 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.536 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 15.3 mmm -55.49 145.02 23.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.138 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.48 146.65 23.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.797 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 86.4 mtm-85 -54.75 -31.37 58.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.797 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.8 -39.0 87.26 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.414 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -67.47 -34.3 76.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.433 179.586 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.571 HD13 HD23 ' A' ' 62' ' ' LEU . 26.1 mm -72.09 -34.0 48.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.721 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -66.68 -46.34 75.95 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.801 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 4.8 mmmt -66.54 -47.54 72.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.694 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.66 -34.18 67.09 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.809 ' O ' HG23 ' A' ' 84' ' ' VAL . 88.3 t80 -64.96 -36.67 85.13 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.676 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.77 -37.79 76.52 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.936 178.493 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.98 -32.26 71.82 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.111 0.481 . . . . 0.0 109.758 178.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.887 HD13 ' CD2' ' A' ' 27' ' ' LEU . 5.0 mt -78.31 -30.62 48.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.021 178.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.809 HG23 ' O ' ' A' ' 80' ' ' TYR . 60.2 t -68.97 -37.05 76.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.368 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -49.15 35.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.452 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.7 p -64.47 -45.28 88.05 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.727 179.662 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 89.4 p -60.21 -49.28 78.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.56 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -54.5 -39.52 67.64 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.764 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -68.12 -31.63 71.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.753 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.447 HD23 HD23 ' A' ' 91' ' ' LEU . 6.8 tt -66.05 -46.46 77.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.997 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.447 HD23 HD23 ' A' ' 90' ' ' LEU . 6.5 mt -65.14 -48.52 73.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.169 0.509 . . . . 0.0 109.809 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.3 m -57.07 -32.68 66.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.539 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.416 ' O ' ' CG ' ' A' ' 96' ' ' LYS . . . -70.07 -53.11 18.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.777 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.657 ' HB3' HD11 ' A' ' 41' ' ' LEU . 14.4 mt -58.87 -42.2 88.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.672 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.97 -49.71 75.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.036 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.416 ' CG ' ' O ' ' A' ' 93' ' ' ALA . 27.3 pttt -61.61 -28.65 69.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.939 0.399 . . . . 0.0 110.46 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mttm . . . . . 0 C--N 1.332 -0.19 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.692 -179.783 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.885 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.5 m . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.766 0.317 . . . . 0.0 110.83 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.703 ' HG ' HG21 ' A' ' 66' ' ' ILE . 2.6 mt -57.06 -35.97 69.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.072 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.503 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.8 p -69.34 -46.69 76.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.191 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.503 ' N ' HG13 ' A' ' 22' ' ' VAL . 25.2 mttt -60.15 -46.52 89.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.168 0.509 . . . . 0.0 110.506 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.885 HG23 ' O ' ' A' ' 20' ' ' SER . 14.4 t -56.83 -45.97 83.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.632 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.76 -38.77 95.75 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.55 -0.833 . . . . 0.0 111.704 179.162 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -56.89 -43.85 81.74 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.057 0.456 . . . . 0.0 110.153 179.416 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.464 HD13 HD13 ' A' ' 83' ' ' LEU . 0.7 OUTLIER -61.63 -42.02 98.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.054 179.254 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.427 ' HA ' HD13 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -52.88 -40.07 63.19 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 178.786 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.53 -38.64 91.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.63 178.44 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.431 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -63.48 -36.56 84.16 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.922 179.12 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.732 HD22 HD12 ' A' ' 59' ' ' ILE . 5.9 mp -62.03 -43.52 98.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.254 179.334 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.28 -47.42 85.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.843 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.454 ' O ' HG23 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -60.06 -33.64 72.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.006 -179.991 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.848 ' O ' HG23 ' A' ' 38' ' ' VAL . 10.8 m-85 -65.59 -43.91 88.25 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.512 179.659 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -60.77 -39.3 88.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.476 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -59.15 -54.69 44.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.478 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 33' ' ' LYS . 24.0 t -58.8 -37.9 69.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.781 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.901 HG11 HG11 ' A' ' 48' ' ' VAL . 55.0 t -70.74 -31.45 45.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.061 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.3 m -73.82 -27.1 60.94 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.98 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.45 -34.86 65.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.413 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.79 HD12 ' O ' ' A' ' 42' ' ' LYS . 4.1 pp -87.79 -25.98 23.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.284 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.79 ' O ' HD12 ' A' ' 41' ' ' LEU . 4.7 mptt 58.55 179.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.974 0.416 . . . . 0.0 111.114 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.5 t70 70.13 149.12 0.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.749 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.595 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 62.47 24.76 66.2 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.375 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.454 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -54.3 -48.93 93.12 Favored Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 111.516 0.191 . . . . 0.0 111.516 -179.836 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 50.5 Cg_exo -53.79 -46.84 30.73 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.292 1.995 . . . . 0.0 112.581 -179.678 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -63.12 -50.44 70.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.412 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.901 HG11 HG11 ' A' ' 38' ' ' VAL . 11.9 t -65.11 -55.78 18.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.148 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.629 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 73.6 m-20 -54.07 -28.42 38.82 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.224 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.4 -49.54 33.07 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.416 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 28.4 mt-30 -74.15 -43.5 57.2 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.532 0.682 . . . . 0.0 109.588 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.605 HG13 HG12 ' A' ' 48' ' ' VAL . 1.2 mt -57.15 -36.2 50.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.376 179.273 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.933 ' HD2' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -69.08 -46.02 68.84 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.187 178.835 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.912 ' HA ' HD12 ' A' ' 57' ' ' ILE . 27.7 m-20 -51.19 -41.34 60.15 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.732 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.592 ' HB2' HD21 ' A' ' 31' ' ' LEU . 5.3 mt -69.25 -43.3 74.25 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 120.722 0.296 . . . . 0.0 110.351 179.33 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.443 ' N ' HD21 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -56.56 -36.43 69.31 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.606 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.933 HD11 ' HD2' ' A' ' 53' ' ' LYS . 10.9 mt -70.96 -42.25 77.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 115.096 -0.957 . . . . 0.0 110.171 178.702 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.904 ' O ' HD12 ' A' ' 62' ' ' LEU . 10.5 m -59.49 -46.12 89.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.419 179.433 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.779 HG23 HG12 ' A' ' 24' ' ' VAL . 46.3 mt -63.97 -53.49 43.37 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.527 179.443 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.435 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 96.0 m-20 -57.26 -34.19 68.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.301 179.437 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.88 -49.1 78.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.783 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.904 HD12 ' O ' ' A' ' 58' ' ' SER . 0.8 OUTLIER -55.78 -56.49 19.93 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.998 179.929 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.439 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.6 -53.78 8.62 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 123.198 0.311 . . . . 0.0 110.792 -179.92 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.07 -25.19 66.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.927 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.447 ' O ' HG23 ' A' ' 69' ' ' THR . 2.3 mtmp? -82.35 -30.42 30.38 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.137 0.494 . . . . 0.0 110.596 179.622 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.703 HG21 ' HG ' ' A' ' 21' ' ' LEU . 1.5 mm -71.22 -33.81 52.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.99 -179.495 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.81 0.95 57.51 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.214 -179.302 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.471 ' O ' HG22 ' A' ' 69' ' ' THR . 2.2 m -142.88 22.12 1.94 Allowed 'General case' 0 C--O 1.233 0.192 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.471 HG22 ' O ' ' A' ' 68' ' ' SER . 1.0 OUTLIER -160.34 157.4 27.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.605 179.206 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.63 36.49 1.77 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.49 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.7 138.71 55.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.071 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.43 HG22 ' H ' ' A' ' 74' ' ' GLU . 13.9 m -74.32 145.71 43.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.806 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.26 -30.61 62.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.668 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.43 ' H ' HG22 ' A' ' 72' ' ' THR . 1.4 tt0 -59.37 -45.1 92.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.427 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -60.24 -33.58 72.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.376 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.667 ' CD1' HD23 ' A' ' 62' ' ' LEU . 19.1 mm -70.88 -34.07 54.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.497 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -50.88 68.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.609 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.8 mmtm -61.14 -46.34 90.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.47 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -56.52 -33.47 66.08 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.925 ' O ' HG23 ' A' ' 84' ' ' VAL . 2.5 t80 -63.81 -38.08 89.78 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 177.719 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.6 -36.36 76.14 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.144 178.597 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.97 -37.36 76.6 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.253 0.549 . . . . 0.0 109.921 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.71 HD21 ' HB2' ' A' ' 58' ' ' SER . 24.8 mt -76.48 -30.08 57.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.112 178.894 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.925 HG23 ' O ' ' A' ' 80' ' ' TYR . 49.0 t -71.11 -34.66 55.74 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.543 179.426 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -72.02 -49.28 38.27 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.436 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.5 m -62.95 -40.81 98.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.28 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.404 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 3.0 m -62.93 -50.07 72.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.513 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -52.38 -41.75 63.39 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.021 0.439 . . . . 0.0 110.747 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -67.5 -32.74 73.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.688 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.515 HD23 HD12 ' A' ' 94' ' ' LEU . 5.1 tt -64.98 -47.08 78.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.964 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.75 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.7 mt -60.88 -48.79 80.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.238 0.542 . . . . 0.0 109.982 179.63 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.04 -42.69 72.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.334 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.91 -36.83 84.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.316 179.432 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.671 HD22 HD21 ' A' ' 41' ' ' LEU . 5.9 mt -66.91 -42.68 85.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.427 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.95 -54.19 47.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.325 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.77 -28.74 69.66 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.261 179.187 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.3 tttm . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.156 179.992 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.41 ' O ' HG23 ' A' ' 24' ' ' VAL . 2.4 m . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.672 0.272 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.614 HD21 ' HB ' ' A' ' 66' ' ' ILE . 0.5 OUTLIER -53.67 -32.76 52.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.085 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.515 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.0 p -57.74 -48.35 83.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.303 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.515 ' N ' HG13 ' A' ' 22' ' ' VAL . 22.0 mttt -64.48 -41.92 96.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.888 0.375 . . . . 0.0 110.421 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.584 HG12 HG23 ' A' ' 59' ' ' ILE . 25.5 t -57.48 -48.49 82.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.703 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -59.35 -41.22 96.83 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.624 -0.798 . . . . 0.0 111.801 179.372 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.69 -36.3 74.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.905 0.383 . . . . 0.0 110.263 179.438 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.521 HD13 HD13 ' A' ' 83' ' ' LEU . 0.4 OUTLIER -64.59 -47.01 80.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.752 179.336 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.53 ' HA ' HD13 ' A' ' 59' ' ' ILE . 5.4 tttm -53.18 -36.37 60.86 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.465 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -68.72 -35.11 76.72 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.451 178.614 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -34.48 77.86 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.893 178.849 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.568 HD21 ' HB2' ' A' ' 55' ' ' LEU . 6.2 mp -63.71 -50.36 69.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.128 179.251 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -58.02 -35.76 71.73 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.19 179.31 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.9 tptt -60.4 -46.13 91.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.348 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.842 ' O ' HG23 ' A' ' 38' ' ' VAL . 21.3 m-85 -59.59 -42.7 93.14 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.49 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -58.28 -40.77 82.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.474 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -59.47 -49.74 76.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.508 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.4 t -63.2 -37.9 80.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.505 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.842 HG23 ' O ' ' A' ' 34' ' ' PHE . 57.2 t -68.23 -38.26 79.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.787 179.708 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.3 m -67.58 -30.72 70.41 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.738 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.57 -29.74 69.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.276 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.573 HD12 ' O ' ' A' ' 42' ' ' LYS . 1.2 pp -100.99 -22.52 14.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.208 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.573 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.2 OUTLIER 63.08 -173.82 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.912 179.902 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 62.24 155.46 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.758 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.811 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 63.7 33.16 86.51 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.319 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.568 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 16.8 mmtp -62.97 -55.29 38.98 Favored Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.568 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 10.0 Cg_endo -53.55 -43.03 61.13 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.561 2.174 . . . . 0.0 112.856 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -66.5 -41.02 89.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.786 0.327 . . . . 0.0 111.185 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 44' ' ' GLY . 47.4 t -71.19 -56.24 11.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.45 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.466 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 21.1 p30 -59.26 -25.46 64.08 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.946 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 11.1 ttt-85 -72.92 -47.14 48.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.778 0.323 . . . . 0.0 111.386 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -76.64 -46.05 27.46 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.421 0.629 . . . . 0.0 109.598 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.762 ' HA ' HD12 ' A' ' 55' ' ' LEU . 1.8 mt -57.39 -34.09 45.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.372 179.109 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.688 ' HG3' HD11 ' A' ' 57' ' ' ILE . 4.9 tptt -69.41 -52.36 27.69 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.534 179.245 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.927 ' HA ' HD12 ' A' ' 57' ' ' ILE . 4.9 m120 -51.52 -34.16 34.94 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.539 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.762 HD12 ' HA ' ' A' ' 52' ' ' ILE . 2.9 mt -76.63 -43.26 39.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.392 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.567 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -56.71 -35.0 68.01 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.415 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.927 HD12 ' HA ' ' A' ' 54' ' ' ASN . 14.0 mt -70.49 -43.49 77.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.187 178.728 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.887 ' O ' HD12 ' A' ' 62' ' ' LEU . 6.7 t -57.91 -45.92 85.77 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.681 179.576 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.584 HG23 HG12 ' A' ' 24' ' ' VAL . 13.9 mt -59.94 -54.47 34.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.757 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -57.54 -33.52 68.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.622 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.81 -49.55 77.27 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.474 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.887 HD12 ' O ' ' A' ' 58' ' ' SER . 1.5 mp -55.73 -55.03 37.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.695 179.283 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.494 ' HE2' HG11 ' A' ' 24' ' ' VAL . 9.3 tpp -45.12 -55.57 5.56 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.267 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.89 -24.24 66.82 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.805 0.336 . . . . 0.0 110.546 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.6 mtmm -82.25 -28.91 31.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.473 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.653 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.1 mm -71.88 -40.65 68.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.336 -179.386 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -92.56 -29.05 16.38 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.773 -179.249 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.762 ' O ' HG23 ' A' ' 69' ' ' THR . 1.2 t -103.14 24.41 10.89 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.714 0.264 . . . . 0.0 111.714 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.762 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 177.53 150.14 0.18 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.156 179.623 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 11.0 ttp -75.17 64.37 1.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.872 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.515 ' CE ' HD13 ' A' ' 76' ' ' ILE . 0.5 OUTLIER -62.63 124.49 21.12 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.779 179.992 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.8 m -77.11 136.38 38.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.771 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.3 mtm180 -52.77 -35.29 56.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.911 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -59.94 -42.34 93.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.458 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -67.22 -32.59 73.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.515 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.564 HD13 HD23 ' A' ' 62' ' ' LEU . 27.1 mm -70.11 -37.13 71.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.828 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -65.1 -50.36 66.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.692 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -63.57 -46.9 83.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.675 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.427 ' O ' HD12 ' A' ' 83' ' ' LEU . 1.1 mt-10 -56.46 -34.0 66.45 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.933 ' O ' HG23 ' A' ' 84' ' ' VAL . 3.5 t80 -64.15 -37.36 87.16 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.61 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -69.72 -36.8 76.2 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.17 178.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.74 -39.89 78.41 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.249 0.547 . . . . 0.0 109.681 179.051 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.716 HD21 ' HB3' ' A' ' 58' ' ' SER . 1.4 mt -74.34 -30.19 61.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.062 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.933 HG23 ' O ' ' A' ' 80' ' ' TYR . 57.3 t -70.2 -36.2 66.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.413 179.322 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.71 -49.43 58.97 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.204 179.467 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.439 ' CB ' HD21 ' A' ' 55' ' ' LEU . 58.5 m -63.95 -43.6 95.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.982 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.43 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 67.3 m -60.98 -50.0 75.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.338 179.329 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -50.3 -43.66 53.76 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.637 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -37.28 86.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.464 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.525 HD23 ' C ' ' A' ' 90' ' ' LEU . 5.9 tt -62.98 -44.14 96.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.929 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.489 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.5 mt -62.63 -48.67 78.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.08 0.466 . . . . 0.0 109.918 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.2 t -57.2 -43.58 82.85 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.645 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.07 -46.17 82.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.797 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.515 ' CD2' HG22 ' A' ' 38' ' ' VAL . 3.4 tp -61.67 -44.97 95.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.827 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.83 -44.86 78.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.775 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -58.4 -48.92 79.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.524 179.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.217 -179.958 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.699 ' O ' HG23 ' A' ' 24' ' ' VAL . 2.1 m . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.806 0.336 . . . . 0.0 110.971 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.471 HD22 ' HG3' ' A' ' 63' ' ' MET . 17.7 mt -53.85 -32.86 54.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.109 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.507 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.9 p -63.99 -46.78 93.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.1 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.507 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -65.71 -46.76 77.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.06 0.457 . . . . 0.0 110.614 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.816 HG12 HG23 ' A' ' 59' ' ' ILE . 6.3 t -57.0 -44.39 82.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.357 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.4 -38.24 95.41 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.646 -0.788 . . . . 0.0 111.574 179.154 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.7 -42.92 84.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.973 0.416 . . . . 0.0 110.102 179.232 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.55 ' O ' HD13 ' A' ' 27' ' ' LEU . 1.5 tm? -61.59 -43.73 98.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.105 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.86 -39.54 62.65 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 178.657 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.83 -36.83 85.59 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.579 178.531 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.06 -33.1 75.23 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.901 178.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.427 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 2.2 mp -62.74 -52.54 62.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.284 179.331 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.77 -36.1 71.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.329 179.463 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.438 ' O ' HG23 ' A' ' 37' ' ' VAL . 5.0 tptm -59.63 -44.67 93.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.411 179.508 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.839 ' O ' HG23 ' A' ' 38' ' ' VAL . 11.5 m-85 -60.93 -43.22 98.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.509 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.24 -46.7 72.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.793 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -58.73 -51.39 70.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.891 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 33' ' ' LYS . 21.7 t -61.32 -40.24 85.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.992 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.876 HG11 HG21 ' A' ' 48' ' ' VAL . 56.2 t -68.0 -39.76 82.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.93 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.5 t -69.12 -25.19 64.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.929 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.21 -32.21 64.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.391 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.746 HD12 ' O ' ' A' ' 42' ' ' LYS . 1.7 pp -96.39 -21.64 17.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.34 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.746 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.1 OUTLIER 60.62 -174.97 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.039 179.862 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.4 t70 70.82 139.14 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.855 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.729 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 60.71 60.35 8.62 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.269 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.485 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 13.9 mmtp -83.68 -46.01 0.79 Allowed Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 111.398 0.147 . . . . 0.0 111.398 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.485 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.9 Cg_exo -53.29 -41.32 73.46 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.322 2.015 . . . . 0.0 112.446 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -67.8 -39.51 83.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.922 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.876 HG21 HG11 ' A' ' 38' ' ' VAL . 33.6 t -70.82 -56.36 11.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.324 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.419 ' O ' ' CG ' ' A' ' 53' ' ' LYS . 15.4 p30 -60.28 -25.33 65.65 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.018 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 7.4 tpp180 -73.55 -43.57 59.58 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.761 0.315 . . . . 0.0 111.405 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.428 ' HA ' ' ND2' ' A' ' 54' ' ' ASN . 3.2 mt-30 -81.31 -44.71 17.26 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.367 0.603 . . . . 0.0 110.0 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.585 HG13 ' O ' ' A' ' 48' ' ' VAL . 2.3 mt -58.09 -40.99 79.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.63 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.474 ' HD3' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -70.5 -50.8 34.04 Favored 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.954 ' HA ' HD12 ' A' ' 57' ' ' ILE . 30.2 p30 -59.68 -25.42 64.73 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.086 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.726 HD22 HD23 ' A' ' 83' ' ' LEU . 50.7 mt -80.02 -43.95 21.01 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.097 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.6 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -56.75 -34.75 67.87 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.412 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.954 HD12 ' HA ' ' A' ' 54' ' ' ASN . 13.3 mt -71.1 -43.5 75.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.1 178.744 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.696 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.0 OUTLIER -58.53 -47.35 84.46 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.334 179.422 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.816 HG23 HG12 ' A' ' 24' ' ' VAL . 9.9 mt -58.44 -53.04 52.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.717 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -59.4 -33.85 71.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.624 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.62 -50.43 73.18 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.978 0.418 . . . . 0.0 110.316 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.696 HD12 ' O ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -56.32 -54.93 39.6 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.306 179.071 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.497 ' HE1' ' HB ' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -44.89 -57.48 3.75 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.191 -179.87 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.45 -24.87 63.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.957 0.408 . . . . 0.0 110.701 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 24.0 mtpt -82.27 -29.59 31.14 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.577 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -72.79 -35.33 49.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.202 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.01 1.26 57.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.16 -179.101 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.444 ' O ' HG22 ' A' ' 69' ' ' THR . 1.4 m -136.22 21.09 3.2 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.945 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.444 HG22 ' O ' ' A' ' 68' ' ' SER . 1.4 p -160.05 -168.35 2.19 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.949 0.404 . . . . 0.0 110.626 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 5.0 tpt -130.92 37.21 3.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.459 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 33.3 mtp -56.61 139.63 49.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.01 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.8 m -74.53 144.08 44.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.715 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.9 mtt180 -55.04 -30.41 59.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.584 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.88 -44.16 86.5 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.249 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -36.29 79.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.021 179.319 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.61 ' CD1' HD23 ' A' ' 62' ' ' LEU . 23.0 mm -71.19 -34.06 53.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.368 179.31 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -52.01 67.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.443 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 mppp? -61.91 -46.4 89.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.33 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.417 ' OE1' HD11 ' A' ' 62' ' ' LEU . 2.9 mt-10 -56.43 -33.78 66.17 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.521 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.901 ' O ' HG23 ' A' ' 84' ' ' VAL . 12.0 t80 -63.54 -37.47 87.44 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.665 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -69.59 -36.2 76.03 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.801 178.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.56 -35.6 74.56 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-O 121.136 0.493 . . . . 0.0 109.728 178.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.726 HD23 HD22 ' A' ' 55' ' ' LEU . 1.6 mt -77.13 -31.58 55.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.062 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.901 HG23 ' O ' ' A' ' 80' ' ' TYR . 41.4 t -71.34 -35.03 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.571 179.473 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.99 -47.32 52.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.598 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.5 m -69.88 -36.86 75.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.709 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.1 m -65.08 -50.46 66.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.697 179.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -39.35 82.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.647 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -65.83 -31.17 71.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.561 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.516 HD23 HD23 ' A' ' 91' ' ' LEU . 6.2 tt -66.67 -48.19 70.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.697 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.516 HD23 HD23 ' A' ' 90' ' ' LEU . 5.8 mt -64.99 -46.64 80.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.168 0.508 . . . . 0.0 109.89 179.331 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.87 -35.43 70.95 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.636 179.553 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.43 -37.61 77.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.669 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.719 HD22 HD21 ' A' ' 41' ' ' LEU . 2.7 mt -71.42 -43.34 66.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.624 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -54.11 48.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.773 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.3 -34.92 77.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.138 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.525 179.377 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.3 p . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.817 0.342 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 10.9 mt -58.94 -32.77 69.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.006 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.7 t -61.71 -52.28 62.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.041 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -53.0 -41.24 64.46 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.999 0.428 . . . . 0.0 110.745 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.509 ' CG1' HG23 ' A' ' 59' ' ' ILE . 51.4 t -60.78 -49.73 83.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.332 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.19 -37.54 93.09 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.703 -0.76 . . . . 0.0 111.837 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.01 -46.86 82.02 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.912 0.387 . . . . 0.0 110.26 179.487 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.752 ' CD2' HD13 ' A' ' 83' ' ' LEU . 22.8 tp -62.01 -37.26 84.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.277 -0.419 . . . . 0.0 109.9 179.04 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.68 -38.89 70.23 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.581 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -38.65 88.29 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.672 178.563 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 20.1 mmt180 -59.8 -38.59 82.35 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.136 -0.483 . . . . 0.0 109.975 179.094 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.731 HD12 ' CD1' ' A' ' 59' ' ' ILE . 5.9 mt -62.5 -48.7 78.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.048 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.02 -38.06 75.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.087 179.255 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.41 ' HE3' ' CG2' ' A' ' 37' ' ' VAL . 5.2 tptt -58.9 -42.23 89.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.018 179.197 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.882 ' O ' HG23 ' A' ' 38' ' ' VAL . 21.3 m-85 -61.13 -43.95 98.09 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.25 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -54.56 -43.31 71.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.555 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.79 -52.61 64.99 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.393 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.41 ' CG2' ' HE3' ' A' ' 33' ' ' LYS . 24.0 t -59.31 -37.81 71.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.582 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.882 HG23 ' O ' ' A' ' 34' ' ' PHE . 41.0 t -70.07 -31.2 46.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.895 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.42 -27.64 61.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.593 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.35 -34.4 76.03 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.205 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.745 HD12 ' O ' ' A' ' 42' ' ' LYS . 1.8 pp -92.07 -20.19 21.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.245 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.745 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER 59.19 -173.55 0.1 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.866 0.365 . . . . 0.0 110.898 179.767 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 64.57 151.56 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.805 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.491 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 59.8 29.17 66.9 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.306 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.545 ' HZ1' HG12 ' A' ' 38' ' ' VAL . 0.4 OUTLIER -56.2 -57.55 21.91 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 120.494 0.188 . . . . 0.0 111.252 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 11.3 Cg_endo -54.96 -33.88 84.39 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.436 2.09 . . . . 0.0 112.228 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -67.07 -49.06 66.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.705 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.87 HG21 HG11 ' A' ' 38' ' ' VAL . 25.8 t -69.93 -55.17 15.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.95 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.595 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 65.3 m-20 -52.85 -32.87 46.92 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.684 0.278 . . . . 0.0 111.106 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.6 ttt85 -72.15 -46.21 57.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.869 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.45 ' NE2' HD12 ' A' ' 90' ' ' LEU . 9.3 pt20 -73.04 -45.59 56.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.657 0.741 . . . . 0.0 109.472 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.538 HG13 HG12 ' A' ' 48' ' ' VAL . 1.7 mt -57.56 -32.89 43.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.314 178.85 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.826 ' HD2' HD11 ' A' ' 57' ' ' ILE . 7.1 tmtm? -69.16 -49.8 53.49 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.343 178.834 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.946 ' HA ' HD12 ' A' ' 57' ' ' ILE . 16.9 m-20 -50.98 -39.84 56.43 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.578 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.674 ' HB3' HD11 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -71.17 -43.01 68.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.182 179.345 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.603 ' HG2' HD13 ' A' ' 31' ' ' LEU . 13.3 mm-40 -57.01 -36.79 70.84 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 178.385 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.946 HD12 ' HA ' ' A' ' 54' ' ' ASN . 12.2 mt -69.63 -42.1 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.173 178.736 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.655 ' O ' HD12 ' A' ' 62' ' ' LEU . 22.7 t -57.62 -51.52 69.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.192 179.463 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.731 ' CD1' HD12 ' A' ' 31' ' ' LEU . 5.9 mt -57.92 -46.49 87.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.281 179.221 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.8 -35.24 75.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.351 179.446 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.92 -49.81 75.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.283 179.361 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.657 HD23 ' CD1' ' A' ' 76' ' ' ILE . 1.6 mp -55.53 -54.0 49.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.439 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.42 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.15 -54.3 7.02 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.291 -179.907 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.95 -25.22 67.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.863 0.363 . . . . 0.0 110.685 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 25.0 mtpt -82.04 -28.66 32.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.565 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.656 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.7 mm -73.06 -38.06 54.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.43 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.15 -27.57 16.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.715 -179.218 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.78 ' O ' HG23 ' A' ' 69' ' ' THR . 1.4 m -105.88 25.33 11.03 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.78 HG23 ' O ' ' A' ' 68' ' ' SER . 0.3 OUTLIER 174.14 155.12 0.12 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.878 179.678 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.6 mmt -83.23 82.44 8.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.946 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -84.18 119.03 24.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.054 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.7 m -73.43 144.34 46.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.607 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -52.65 -34.07 49.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.948 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -58.25 -49.09 78.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.47 179.563 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.32 -34.35 72.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.179 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.843 HG22 ' CE2' ' A' ' 80' ' ' TYR . 21.9 mm -72.4 -34.19 47.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.574 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' ' 80' ' ' TYR . 3.2 tp-100 -60.54 -48.58 81.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.519 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.71 -45.74 85.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.35 179.526 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.91 -35.99 69.65 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 178.709 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.918 ' O ' HG23 ' A' ' 84' ' ' VAL . 9.5 m-85 -63.59 -35.08 79.31 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.554 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -68.92 -36.76 78.36 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.831 178.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.09 -35.16 76.25 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.261 0.553 . . . . 0.0 109.573 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.752 HD13 ' CD2' ' A' ' 27' ' ' LEU . 1.9 mt -76.56 -31.96 57.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.035 178.878 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.918 HG23 ' O ' ' A' ' 80' ' ' TYR . 49.3 t -69.15 -34.16 62.02 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.362 179.414 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.9 mmpt? -72.03 -49.12 39.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.426 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 m -68.27 -37.52 80.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.609 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 98.7 p -67.06 -49.08 66.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.663 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -55.88 -43.96 77.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.975 0.417 . . . . 0.0 110.779 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -67.29 -30.67 70.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.729 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.45 HD12 ' NE2' ' A' ' 51' ' ' GLN . 7.1 tt -63.17 -47.63 81.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.018 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.647 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.4 mt -63.54 -47.2 82.57 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.215 0.531 . . . . 0.0 109.84 179.383 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 49.4 m -58.31 -42.93 87.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.505 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.77 -33.49 75.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.566 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.634 HD11 HG13 ' A' ' 38' ' ' VAL . 11.9 tp -67.59 -49.18 64.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.669 179.745 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -55.75 -47.0 77.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.597 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.1 pttp -65.34 -28.74 69.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.03 0.443 . . . . 0.0 109.825 178.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt . . . . . 0 C--O 1.231 0.12 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.177 179.786 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.9 p . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.74 0.305 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.487 HD21 ' HB ' ' A' ' 66' ' ' ILE . 3.5 mt -55.11 -32.5 62.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.165 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.5 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.5 p -51.78 -46.99 40.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.36 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.5 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.5 OUTLIER -63.69 -43.83 95.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.14 0.495 . . . . 0.0 110.371 179.687 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.523 ' CG1' HG23 ' A' ' 59' ' ' ILE . 21.1 t -57.61 -44.47 85.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.492 179.357 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.16 -38.57 96.38 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.716 179.301 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.82 -46.06 81.88 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.079 0.466 . . . . 0.0 110.096 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.871 HD23 HG12 ' A' ' 59' ' ' ILE . 9.5 tp -62.12 -37.19 84.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.883 178.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.56 -38.77 69.76 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.671 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -38.01 84.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.706 178.651 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -61.22 -37.17 82.07 Favored 'General case' 0 N--CA 1.458 -0.068 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.178 179.336 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.655 HD23 HD11 ' A' ' 59' ' ' ILE . 2.6 mm? -63.91 -52.19 61.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.174 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.04 -32.43 67.97 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.303 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.6 tptt -63.07 -45.13 93.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.326 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.848 ' O ' HG23 ' A' ' 38' ' ' VAL . 13.3 m-85 -60.4 -43.4 96.7 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.59 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -57.33 -42.64 82.31 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.726 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.01 -52.45 65.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.715 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.42 ' O ' HD23 ' A' ' 41' ' ' LEU . 21.7 t -60.95 -37.95 78.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.871 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.924 HG22 HD21 ' A' ' 94' ' ' LEU . 56.1 t -70.09 -32.77 52.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.037 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -72.68 -29.32 63.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.861 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.05 -28.73 64.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.21 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.867 HD12 ' O ' ' A' ' 42' ' ' LYS . 2.2 pp -101.49 -24.25 14.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.202 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.867 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER 60.49 -169.7 0.15 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.816 179.88 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 64.51 136.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.76 -179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.887 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 72.2 26.16 72.84 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.327 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.564 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 1.9 mmtt -56.53 -55.72 39.73 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.52 0.2 . . . . 0.0 111.354 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.564 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 9.8 Cg_endo -53.49 -44.15 51.48 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.348 2.032 . . . . 0.0 112.275 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.88 -49.45 77.41 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.034 0.445 . . . . 0.0 110.511 179.664 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 44' ' ' GLY . 17.8 t -60.9 -55.28 25.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.756 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.412 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 42.5 m-20 -54.83 -25.61 29.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.115 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -50.41 28.63 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.843 0.354 . . . . 0.0 111.555 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -74.89 -45.17 44.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.496 0.665 . . . . 0.0 109.398 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.699 HG12 HD11 ' A' ' 90' ' ' LEU . 1.5 mt -57.81 -32.35 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.276 178.787 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.572 ' HG2' HD11 ' A' ' 57' ' ' ILE . 26.9 tttt -69.35 -52.75 24.19 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.429 179.242 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.938 ' HA ' HD12 ' A' ' 57' ' ' ILE . 6.3 m120 -50.95 -39.3 54.64 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.743 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 1.041 HD13 HD23 ' A' ' 83' ' ' LEU . 0.3 OUTLIER -70.65 -43.68 68.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.283 179.592 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.72 -35.87 69.04 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.53 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.938 HD12 ' HA ' ' A' ' 54' ' ' ASN . 11.9 mt -71.12 -42.56 75.9 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.31 178.723 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.838 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.1 m -58.89 -49.68 76.88 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.406 179.5 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.871 HG12 HD23 ' A' ' 27' ' ' LEU . 36.0 mt -60.79 -53.49 48.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.552 179.567 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.84 -34.69 71.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.503 179.623 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.67 -49.7 75.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.269 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.838 HD12 ' O ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -55.76 -54.67 41.53 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.405 179.186 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.463 ' HE1' ' HB ' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.0 -58.08 3.41 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.218 -179.899 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.17 -24.53 63.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.881 0.372 . . . . 0.0 110.552 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.442 ' O ' HG23 ' A' ' 69' ' ' THR . 0.0 OUTLIER -82.14 -29.44 31.62 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.633 179.496 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.646 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -73.0 -34.84 47.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.278 -179.443 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -87.61 -28.28 22.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.973 -179.163 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.485 ' O ' HG22 ' A' ' 69' ' ' THR . 48.0 t -101.31 17.63 22.1 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.485 HG22 ' O ' ' A' ' 68' ' ' SER . 0.8 OUTLIER -161.46 -168.02 1.89 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.612 179.376 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.83 39.06 3.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.232 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -51.66 152.7 2.68 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.328 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.7 m -86.12 147.41 26.17 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.803 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -30.93 65.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.585 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -46.28 88.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.282 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -60.42 -33.77 73.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.368 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.595 ' CD1' HD23 ' A' ' 62' ' ' LEU . 23.0 mm -71.07 -35.13 57.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.46 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -62.39 -45.46 93.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.562 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.8 tptp -67.01 -49.03 66.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.449 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.541 ' O ' HD12 ' A' ' 83' ' ' LEU . 49.5 mt-10 -56.73 -34.1 67.18 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.657 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.919 ' O ' HG23 ' A' ' 84' ' ' VAL . 15.4 t80 -64.8 -35.64 81.73 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.42 -0.955 . . . . 0.0 108.42 177.669 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.52 -36.92 76.86 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.896 178.608 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.23 -36.87 78.71 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 178.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 1.041 HD23 HD13 ' A' ' 55' ' ' LEU . 1.3 mt -75.75 -31.75 59.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.944 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.919 HG23 ' O ' ' A' ' 80' ' ' TYR . 87.9 t -67.13 -34.17 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.23 179.292 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 16.2 tptt -72.13 -49.36 36.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.095 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.477 ' HB3' HD11 ' A' ' 55' ' ' LEU . 1.1 t -61.78 -40.84 96.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.323 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.7 p -64.41 -48.95 73.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.438 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.91 -44.04 49.93 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.595 179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.18 -29.72 66.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.564 179.439 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.699 HD11 HG12 ' A' ' 52' ' ' ILE . 9.1 tt -65.43 -48.96 70.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.807 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.492 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.6 mt -62.33 -45.63 92.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.203 0.525 . . . . 0.0 109.665 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 60.3 p -54.79 -42.94 72.4 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.382 179.374 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.06 -45.23 94.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.43 179.387 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.924 HD21 HG22 ' A' ' 38' ' ' VAL . 0.5 OUTLIER -54.93 -49.11 72.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.239 179.442 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -56.4 -38.69 71.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.414 179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.62 -32.27 73.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.029 179.14 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.1 mttt . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.249 179.972 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.819 0.343 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -143.85 166.42 27.01 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.529 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -52.58 -61.82 0.44 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.551 2.167 . . . . 0.0 112.342 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.6 ' O ' HG12 ' A' ' 22' ' ' VAL . . . 75.94 -90.78 0.88 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.511 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 m -85.21 -24.85 27.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.712 0.291 . . . . 0.0 111.001 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.727 ' HG ' HG21 ' A' ' 66' ' ' ILE . 1.3 mt -55.18 -32.81 62.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.004 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.6 HG12 ' O ' ' A' ' 19' ' ' GLY . 11.3 p -53.33 -46.0 57.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.309 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.501 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -59.66 -46.31 89.43 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.027 0.441 . . . . 0.0 110.537 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.49 ' CG1' HG23 ' A' ' 59' ' ' ILE . 20.6 t -56.92 -43.82 81.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.665 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -63.71 -37.53 94.86 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.644 -0.789 . . . . 0.0 111.891 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.06 -47.94 79.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.895 0.379 . . . . 0.0 110.224 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.623 HD12 ' CE2' ' A' ' 80' ' ' TYR . 0.8 OUTLIER -61.22 -41.02 96.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.072 179.387 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.06 -38.58 62.6 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 mptt -65.85 -40.54 91.8 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.496 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.4 mmt85 -63.06 -33.3 75.15 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.775 178.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.578 HD12 ' CD1' ' A' ' 59' ' ' ILE . 0.4 OUTLIER -62.58 -49.25 75.98 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.218 179.281 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.91 -37.58 74.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.162 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 tptm -59.02 -43.5 91.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.288 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.822 ' O ' HG23 ' A' ' 38' ' ' VAL . 14.1 m-85 -62.47 -40.53 96.96 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.324 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.06 -45.41 79.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.668 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -59.67 -55.27 36.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.575 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 24.1 t -56.08 -38.0 51.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.933 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 1.026 HG11 HG11 ' A' ' 48' ' ' VAL . 49.2 t -75.25 -33.19 27.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.87 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.03 -32.52 73.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.43 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -83.08 -1.79 53.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.537 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.2 mt -89.54 -56.18 3.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.793 0.33 . . . . 0.0 111.006 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.04 3.66 4.45 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.652 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -116.69 138.34 51.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.771 0.32 . . . . 0.0 110.761 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.785 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 58.18 52.05 54.83 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.275 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.506 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 5.8 mmtm -72.05 -43.19 10.32 Favored Pre-proline 0 C--N 1.329 -0.289 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.506 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.5 Cg_exo -53.42 -48.92 19.33 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.226 1.95 . . . . 0.0 112.771 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -65.46 -38.68 90.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.531 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.026 HG11 HG11 ' A' ' 38' ' ' VAL . 25.8 t -72.4 -56.95 8.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.621 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.573 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 28.5 p30 -58.95 -26.17 64.18 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.067 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 54.7 ttm-85 -73.69 -46.37 46.69 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.97 0.414 . . . . 0.0 111.504 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -74.96 -47.44 29.43 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.525 0.679 . . . . 0.0 109.203 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.621 HG13 ' O ' ' A' ' 48' ' ' VAL . 3.7 mt -57.91 -30.92 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.759 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.25 178.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.573 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -70.23 -55.16 9.97 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.594 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.78 ' HA ' HD12 ' A' ' 57' ' ' ILE . 28.2 p30 -59.73 -25.7 65.03 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 120.871 -0.331 . . . . 0.0 111.181 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.845 ' O ' HD12 ' A' ' 59' ' ' ILE . 45.5 mt -77.44 -46.51 22.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.746 0.308 . . . . 0.0 110.226 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.441 ' HG2' HD13 ' A' ' 31' ' ' LEU . 0.5 OUTLIER -56.69 -37.72 71.27 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.634 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.78 HD12 ' HA ' ' A' ' 54' ' ' ASN . 9.7 mt -71.4 -39.93 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.109 178.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.675 ' O ' HD12 ' A' ' 62' ' ' LEU . 16.1 t -57.76 -55.12 38.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.506 179.521 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.845 HD12 ' O ' ' A' ' 55' ' ' LEU . 2.7 mp -58.87 -47.8 88.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.424 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -60.31 -33.95 73.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.352 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.58 -49.5 77.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.327 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.675 HD12 ' O ' ' A' ' 58' ' ' SER . 1.5 mp -55.5 -52.9 62.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.467 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.476 ' HE1' ' HB ' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.25 -54.07 7.51 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.111 179.769 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.45 -24.83 67.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.598 179.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -81.9 -29.11 32.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.336 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.727 HG21 ' HG ' ' A' ' 21' ' ' LEU . 1.9 mm -71.98 -37.63 61.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.031 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.86 -27.96 16.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.571 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.766 ' O ' HG23 ' A' ' 69' ' ' THR . 1.6 t -104.12 24.54 11.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.704 0.288 . . . . 0.0 111.58 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.766 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 175.89 150.05 0.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.823 179.512 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.7 mtt -83.94 72.91 10.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.916 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 8.3 mmm -74.62 138.81 43.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.688 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.2 m -78.06 139.37 39.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.855 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -55.48 -35.02 65.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.665 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -58.27 -44.47 88.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.351 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -61.67 -32.86 73.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.285 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.591 HD13 HD23 ' A' ' 62' ' ' LEU . 22.8 mm -73.1 -36.65 51.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.742 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 37.5 tp60 -60.22 -52.28 65.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.667 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.53 -46.3 86.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.432 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.56 ' CD ' HD21 ' A' ' 62' ' ' LEU . 19.2 mt-10 -56.7 -34.21 67.21 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 178.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.902 ' O ' HG23 ' A' ' 84' ' ' VAL . 36.5 t80 -64.5 -36.28 83.67 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.44 -37.07 77.22 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.89 178.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.58 -36.07 75.52 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.257 0.551 . . . . 0.0 109.642 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 20.9 mt -76.1 -31.66 58.8 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.066 178.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.902 HG23 ' O ' ' A' ' 80' ' ' TYR . 51.1 t -69.41 -34.43 62.26 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.518 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 18.2 mmtt -71.98 -49.18 39.47 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.357 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.572 ' HB3' HD21 ' A' ' 55' ' ' LEU . 0.3 OUTLIER -67.68 -42.28 82.37 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.463 179.532 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.411 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 72.6 m -65.08 -47.2 78.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.475 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -54.3 -44.67 72.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.623 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.64 -35.03 79.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.61 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.426 HD23 HD23 ' A' ' 91' ' ' LEU . 5.3 tt -60.24 -45.91 91.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.849 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.426 HD23 HD23 ' A' ' 90' ' ' LEU . 7.1 mt -61.58 -51.95 66.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.069 0.462 . . . . 0.0 109.809 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.1 m -56.11 -41.28 75.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.353 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.21 -40.51 90.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.547 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 1.007 HD21 HG22 ' A' ' 38' ' ' VAL . 5.4 mp -63.85 -44.14 94.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.417 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.435 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 5.4 mp0 -55.85 -50.63 70.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.679 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 16.3 pttp -62.39 -28.65 69.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.101 0.477 . . . . 0.0 109.782 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.33 -55.77 9.47 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.417 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.435 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 0.0 OUTLIER -61.88 -47.6 84.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.185 -179.352 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.49 -31.38 72.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.821 0.344 . . . . 0.0 110.925 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -68.14 -39.87 82.57 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.728 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 58.9 28.69 17.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.991 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -160.9 130.57 4.92 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.873 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.259 179.99 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.912 0.387 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -74.85 146.42 35.19 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.507 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -54.21 129.33 33.95 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.47 2.113 . . . . 0.0 112.345 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.575 ' O ' HG12 ' A' ' 22' ' ' VAL . . . -123.83 -90.44 0.92 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.473 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.514 ' O ' HG23 ' A' ' 24' ' ' VAL . 0.2 OUTLIER -76.16 -19.21 58.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.647 0.26 . . . . 0.0 111.104 179.858 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.2 mp -53.89 -32.71 54.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.129 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.575 HG12 ' O ' ' A' ' 19' ' ' GLY . 10.8 p -55.35 -49.68 71.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.268 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.536 ' N ' HG13 ' A' ' 22' ' ' VAL . 35.3 mttt -68.92 -43.91 74.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.897 0.379 . . . . 0.0 110.48 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 20' ' ' SER . 21.0 t -57.12 -40.18 71.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.286 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.53 -39.73 94.04 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.679 -0.772 . . . . 0.0 111.614 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -32.52 72.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.896 0.379 . . . . 0.0 110.087 179.307 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.686 HD13 HD13 ' A' ' 83' ' ' LEU . 0.3 OUTLIER -68.1 -49.9 58.25 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.772 179.137 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -52.99 -33.39 51.27 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.96 -39.3 79.56 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.416 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.445 ' HG3' ' CZ ' ' A' ' 34' ' ' PHE . 2.0 tpt180 -64.12 -31.97 73.36 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.442 ' CD1' HD12 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -65.96 -46.25 78.79 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.066 179.097 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -58.06 -37.37 74.3 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.859 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -59.75 -49.78 76.4 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.949 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.743 ' O ' HG23 ' A' ' 38' ' ' VAL . 11.3 m-85 -60.82 -37.87 83.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.38 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 27.3 m-80 -58.4 -43.54 88.61 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.411 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -51.15 71.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.147 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 36.8 t -57.46 -37.71 59.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.333 179.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.842 ' HA ' HD12 ' A' ' 41' ' ' LEU . 95.5 t -68.57 -41.84 83.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.639 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.8 t -58.17 -34.35 70.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.672 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -86.5 -16.15 37.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.326 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.842 HD12 ' HA ' ' A' ' 38' ' ' VAL . 12.4 mt -74.53 -50.67 17.21 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.167 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 0.1 OUTLIER 67.19 10.47 7.74 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.716 -179.706 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -131.4 152.92 50.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.729 0.299 . . . . 0.0 110.908 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 56.47 33.11 61.68 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.359 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.535 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 17.8 mmtt -53.54 -57.1 18.58 Favored Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 111.53 0.196 . . . . 0.0 111.53 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 14.2 Cg_endo -57.41 -41.76 68.94 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.391 2.061 . . . . 0.0 113.004 -179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -64.96 -50.77 65.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.841 0.353 . . . . 0.0 111.509 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.539 ' O ' HG13 ' A' ' 52' ' ' ILE . 8.4 p -69.2 -49.74 58.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.703 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.521 ' N ' HG13 ' A' ' 48' ' ' VAL . 44.8 p30 -61.83 -25.14 67.33 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.105 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.438 ' N ' ' OD1' ' A' ' 49' ' ' ASN . 1.0 OUTLIER -73.47 -47.76 38.85 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.808 0.337 . . . . 0.0 111.097 179.875 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -74.76 -46.62 35.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.509 0.671 . . . . 0.0 109.382 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.898 HD11 HD11 ' A' ' 90' ' ' LEU . 1.4 mt -57.27 -32.57 41.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 CA-C-N 114.801 -1.09 . . . . 0.0 110.299 178.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 9.0 tttt -69.29 -53.26 20.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.348 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.93 ' HA ' HD12 ' A' ' 57' ' ' ILE . 3.9 m120 -53.78 -29.22 39.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.83 0.348 . . . . 0.0 110.861 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.89 HD12 ' HA ' ' A' ' 52' ' ' ILE . 4.1 mt -77.16 -47.92 19.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.243 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' A' ' 57' ' ' ILE . 0.0 OUTLIER -56.39 -31.3 63.71 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 178.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.93 HD12 ' HA ' ' A' ' 54' ' ' ASN . 14.8 mt -71.6 -43.57 71.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.107 178.225 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.747 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.2 m -58.35 -53.14 61.69 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.772 179.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.442 HD12 ' CD1' ' A' ' 31' ' ' LEU . 23.0 mt -57.04 -52.43 56.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.791 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.4 -33.79 68.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.306 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -58.63 -49.35 77.82 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.107 179.232 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.747 HD12 ' O ' ' A' ' 58' ' ' SER . 1.9 mp -55.34 -53.22 58.96 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.446 179.127 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.461 ' HE3' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.4 -53.05 9.19 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.042 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.4 ' O ' ' CB ' ' A' ' 68' ' ' SER . . . -63.27 -25.09 68.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.653 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 26.4 mtpt -82.03 -28.87 32.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.132 0.491 . . . . 0.0 110.641 179.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.653 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.0 mm -71.49 -41.84 72.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.394 -179.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.66 -29.12 16.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.799 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.782 ' O ' HG23 ' A' ' 69' ' ' THR . 0.3 OUTLIER -101.41 21.8 13.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.527 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.782 HG23 ' O ' ' A' ' 68' ' ' SER . 0.5 OUTLIER 178.05 155.88 0.38 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.93 179.502 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.97 81.65 4.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.801 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.4 mmm -86.68 141.44 28.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.948 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.8 m -77.96 139.89 39.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.924 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -53.99 -31.99 52.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.95 0.405 . . . . 0.0 110.878 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -59.3 -49.09 79.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.535 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -61.87 -32.3 72.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.44 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.584 ' CD1' HD23 ' A' ' 62' ' ' LEU . 20.5 mm -71.75 -33.94 50.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.74 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -46.6 76.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.926 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 21.8 mmtt -63.4 -51.25 66.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.75 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -56.3 -33.71 65.82 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.923 ' O ' HG23 ' A' ' 84' ' ' VAL . 2.9 t80 -64.44 -36.19 83.37 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.551 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.36 -36.65 77.06 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.959 178.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.91 -39.13 80.58 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 121.285 0.565 . . . . 0.0 109.644 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.686 HD13 HD13 ' A' ' 27' ' ' LEU . 2.1 mt -75.13 -29.49 60.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.095 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.923 HG23 ' O ' ' A' ' 80' ' ' TYR . 64.0 t -71.04 -37.4 67.35 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.269 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -49.31 64.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.181 179.397 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.589 ' HB3' HD21 ' A' ' 55' ' ' LEU . 0.2 OUTLIER -67.03 -35.52 80.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.145 179.287 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.435 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 7.3 t -65.69 -46.84 77.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.439 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.588 ' OE1' HG12 ' A' ' 84' ' ' VAL . 25.8 mt-10 -56.13 -47.24 78.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.117 0.484 . . . . 0.0 110.649 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.44 -31.37 72.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.735 179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.898 HD11 HD11 ' A' ' 52' ' ' ILE . 4.6 tt -63.99 -42.2 97.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.954 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.4 mt -64.6 -50.34 67.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.201 0.524 . . . . 0.0 110.016 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.6 m -59.08 -39.18 81.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.838 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.4 -53.27 17.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.098 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.494 HD21 HG22 ' A' ' 38' ' ' VAL . 7.1 mp -58.33 -33.59 69.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.024 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.499 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -66.98 -51.78 50.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.851 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.424 ' HA ' ' CG ' ' A' ' 99' ' ' GLN . 10.0 pttp -57.53 -28.46 63.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.188 0.518 . . . . 0.0 110.078 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.8 mttp -67.95 -58.59 4.29 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.946 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 0.0 OUTLIER -61.28 -42.19 98.22 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.933 -178.779 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLN . . . . . 0.424 ' CG ' ' HA ' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -65.03 -35.55 81.54 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.126 -0.23 . . . . 0.0 111.344 -179.524 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -75.23 -53.54 8.62 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.736 0.303 . . . . 0.0 110.813 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 46.82 -170.13 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.196 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -85.11 -52.83 5.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.651 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.914 179.855 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.851 0.357 . . . . 0.0 111.066 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.414 ' N ' ' HD3' ' A' ' 18' ' ' PRO . . . 57.79 61.9 6.93 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.771 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.414 ' HD3' ' N ' ' A' ' 17' ' ' GLY . 39.4 Cg_exo -60.22 -50.19 7.79 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.634 2.223 . . . . 0.0 112.075 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.93 89.1 1.46 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.477 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 86.2 p -177.94 -38.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.807 0.337 . . . . 0.0 110.843 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.453 HD21 ' HB ' ' A' ' 66' ' ' ILE . 27.9 mt -54.83 -32.89 61.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.945 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.491 HG13 ' N ' ' A' ' 23' ' ' LYS . 12.3 p -59.11 -45.65 92.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.228 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.491 ' N ' HG13 ' A' ' 22' ' ' VAL . 8.0 mmtt -57.98 -44.59 87.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.059 0.457 . . . . 0.0 110.661 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.44 HG12 ' CG2' ' A' ' 59' ' ' ILE . 14.9 t -56.81 -44.93 82.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.612 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.73 -37.45 94.29 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.721 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.1 m -57.01 -47.27 81.24 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.993 0.425 . . . . 0.0 110.35 179.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.64 HD13 ' CE2' ' A' ' 80' ' ' TYR . 5.1 tp -60.74 -41.4 95.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.166 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -54.37 -36.82 64.29 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.96 -38.71 86.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.681 178.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 mpt_? -63.18 -34.87 78.58 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.89 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.55 HD12 HD12 ' A' ' 59' ' ' ILE . 13.2 mt -63.17 -49.71 73.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.197 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.99 -36.86 73.24 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.11 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.0 tptm -59.32 -44.36 92.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.236 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.815 ' O ' HG23 ' A' ' 38' ' ' VAL . 7.6 m-85 -62.57 -37.59 86.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.165 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -58.71 -41.6 86.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.439 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.86 -55.15 32.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.495 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.6 t -55.83 -37.87 49.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.573 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 1.024 HG21 HG11 ' A' ' 48' ' ' VAL . 61.1 t -74.22 -35.07 39.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.519 179.56 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -35.3 71.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.196 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.2 -31.0 68.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.838 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.681 HD13 ' HB2' ' A' ' 98' ' ' LYS . 1.3 pp -117.31 80.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.743 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.74 -27.64 5.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.245 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -58.64 98.9 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.877 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.555 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 95.66 40.45 4.14 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.5 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.451 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -71.58 -49.98 10.81 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.605 0.24 . . . . 0.0 111.181 -179.952 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.451 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.1 Cg_exo -53.28 -40.36 77.98 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.427 2.085 . . . . 0.0 112.657 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -59.93 -50.56 73.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.02 0.438 . . . . 0.0 110.817 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.024 HG11 HG21 ' A' ' 38' ' ' VAL . 4.0 t -66.2 -55.32 19.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.749 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.583 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 83.9 m-20 -52.92 -27.86 20.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.049 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 48.8 ttt-85 -71.75 -53.4 13.55 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.916 0.388 . . . . 0.0 111.899 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.4 ' HA ' HD21 ' A' ' 54' ' ' ASN . 6.0 mt-30 -69.74 -43.84 71.47 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.786 0.803 . . . . 0.0 109.082 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.601 HG13 HG12 ' A' ' 48' ' ' VAL . 1.4 mt -59.52 -29.99 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.869 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.212 178.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.583 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -69.94 -55.11 10.51 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.403 179.717 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.899 ' HA ' HD12 ' A' ' 57' ' ' ILE . 27.5 p30 -60.19 -25.7 65.78 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.917 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.487 HD22 HD23 ' A' ' 83' ' ' LEU . 19.4 mt -79.84 -39.07 31.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.731 0.3 . . . . 0.0 110.198 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.73 -36.39 82.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 178.326 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.899 HD12 ' HA ' ' A' ' 54' ' ' ASN . 10.2 mt -69.93 -39.23 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.94 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.733 ' O ' HD12 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -57.37 -45.87 83.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.128 179.407 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.55 HD12 HD12 ' A' ' 31' ' ' LEU . 64.0 mt -61.52 -51.1 76.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.127 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -58.98 -33.59 70.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.094 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -57.53 -49.42 76.39 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.885 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.733 HD12 ' O ' ' A' ' 58' ' ' SER . 1.1 mp -55.23 -51.58 66.14 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.108 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.457 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.35 -54.79 6.75 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.97 179.819 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.47 -25.18 67.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.641 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.439 ' O ' HG23 ' A' ' 69' ' ' THR . 50.8 mtmt -82.13 -29.49 31.63 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 121.105 0.478 . . . . 0.0 110.483 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.8 mm -70.84 -36.53 64.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.939 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.2 mmmm -94.85 1.23 55.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.93 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.454 ' O ' HG22 ' A' ' 69' ' ' THR . 10.1 m -134.12 21.25 3.76 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.454 HG22 ' O ' ' A' ' 68' ' ' SER . 1.4 p -160.22 -167.6 1.97 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.565 179.343 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.5 mtm -125.37 33.13 5.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.492 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.1 mtp -58.04 123.69 16.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.091 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.0 m -67.58 145.57 54.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.742 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -55.15 -30.82 60.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.652 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -59.0 -45.55 90.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.314 179.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -33.95 72.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.094 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.592 ' CD1' HD23 ' A' ' 62' ' ' LEU . 18.3 mm -72.96 -33.95 44.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.425 179.326 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.22 -46.2 91.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.564 179.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -66.37 -48.54 69.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.467 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.552 ' O ' HD12 ' A' ' 83' ' ' LEU . 5.1 mt-10 -56.57 -33.99 66.7 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.861 ' O ' HG23 ' A' ' 84' ' ' VAL . 9.3 t80 -64.35 -36.52 84.39 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.71 -37.45 76.56 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.963 178.521 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.29 -34.07 73.24 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 121.203 0.525 . . . . 0.0 109.803 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.631 HD13 ' CD2' ' A' ' 27' ' ' LEU . 1.3 mt -76.78 -31.44 57.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.04 178.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.861 HG23 ' O ' ' A' ' 80' ' ' TYR . 56.7 t -68.59 -36.83 76.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.537 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.02 -49.15 39.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.564 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.76 -41.16 92.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.625 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.415 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 43.1 m -63.62 -50.35 69.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.574 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.58 -42.85 68.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.728 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -69.92 -27.05 64.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.81 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.508 HD23 HD23 ' A' ' 91' ' ' LEU . 5.5 tt -69.83 -49.11 55.73 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.017 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.565 HD21 ' CD1' ' A' ' 34' ' ' PHE . 7.2 mt -62.32 -50.9 69.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.123 0.487 . . . . 0.0 109.916 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.7 m -56.38 -34.2 66.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.725 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.18 -53.13 21.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.272 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.676 HD22 HG22 ' A' ' 38' ' ' VAL . 2.8 pp -68.63 -28.84 67.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.103 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.443 ' HB2' ' O ' ' A' ' 91' ' ' LEU . 10.0 tt0 -63.87 -54.13 39.68 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.864 0.364 . . . . 0.0 110.492 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -67.14 -29.52 69.25 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.58 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.03 -32.38 65.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.922 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.681 ' HB2' HD13 ' A' ' 41' ' ' LEU . 0.6 OUTLIER -76.44 -42.32 44.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.753 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -68.88 -37.96 79.38 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.805 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -78.51 -38.4 40.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.015 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 62.73 -84.48 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.753 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 58.47 17.45 4.89 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.499 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 . . . . . 0 C--N 1.328 -0.343 0 CA-C-O 120.812 0.339 . . . . 0.0 110.979 -179.841 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.846 0.355 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.2 -167.88 47.89 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.579 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.89 77.67 1.1 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.678 2.252 . . . . 0.0 112.235 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -122.87 45.52 1.19 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.442 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.445 ' O ' HG23 ' A' ' 24' ' ' VAL . 0.3 OUTLIER -177.26 -39.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.903 0.382 . . . . 0.0 110.866 179.958 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.441 ' HG ' HG21 ' A' ' 66' ' ' ILE . 1.6 mp -58.57 -32.99 69.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.975 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.521 HG13 ' N ' ' A' ' 23' ' ' LYS . 9.8 p -60.51 -47.63 91.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.335 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.521 ' N ' HG13 ' A' ' 22' ' ' VAL . 12.5 mttm -59.81 -49.93 75.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.081 0.467 . . . . 0.0 110.349 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.657 HG12 HG23 ' A' ' 59' ' ' ILE . 10.7 t -56.85 -40.79 73.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.256 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -64.54 -37.57 94.59 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.479 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -56.86 -43.75 81.52 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.131 0.491 . . . . 0.0 109.897 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.87 HD12 HD11 ' A' ' 59' ' ' ILE . 0.2 OUTLIER -63.36 -40.15 96.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.732 178.909 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -53.82 -36.91 63.01 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.04 -42.63 84.48 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.675 178.63 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.55 -31.19 72.28 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.851 178.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.951 HD22 HD12 ' A' ' 59' ' ' ILE . 1.7 tp -63.58 -50.9 67.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.163 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.21 -34.44 72.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.176 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -45.27 94.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.312 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.882 ' O ' HG23 ' A' ' 38' ' ' VAL . 7.7 m-85 -60.38 -44.1 95.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.232 179.493 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -57.24 -37.28 72.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.58 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -61.17 -55.15 35.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.362 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 39.5 t -57.82 -37.61 61.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.368 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.882 HG23 ' O ' ' A' ' 34' ' ' PHE . 47.5 t -67.34 -43.7 87.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.853 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 m -55.81 -39.57 71.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.723 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.71 -27.74 68.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.031 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.776 HD22 ' HB3' ' A' ' 98' ' ' LYS . 44.2 mt -70.66 -40.27 73.11 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.999 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 63.61 14.16 7.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.41 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -138.42 158.45 44.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.688 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.769 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 58.7 30.53 65.88 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.27 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.612 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 1.6 mmtp -54.65 -52.08 73.12 Favored Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.612 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 11.0 Cg_endo -55.03 -49.28 17.13 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.447 2.098 . . . . 0.0 113.316 -179.092 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -59.66 -50.27 74.53 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.54 0.21 . . . . 0.0 111.436 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.769 HG23 ' O ' ' A' ' 44' ' ' GLY . 2.7 t -66.23 -55.39 19.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 120.841 0.353 . . . . 0.0 110.668 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.635 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 13.8 m120 -52.7 -29.99 29.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.204 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -49.84 38.61 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.497 ' HB2' HD12 ' A' ' 90' ' ' LEU . 39.6 mt-30 -71.33 -45.96 61.73 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 179.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.749 ' CD1' HG12 ' A' ' 48' ' ' VAL . 3.6 mt -57.13 -30.4 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.461 178.795 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.893 ' CD ' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -69.12 -50.87 44.06 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 178.634 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.918 ' HA ' HD12 ' A' ' 57' ' ' ILE . 4.6 m120 -51.29 -38.69 54.21 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.385 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 27.9 mt -70.92 -43.4 68.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.084 179.331 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.82 ' HG2' HD23 ' A' ' 31' ' ' LEU . 1.6 mm-40 -56.65 -36.91 70.06 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.436 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.918 HD12 ' HA ' ' A' ' 54' ' ' ASN . 10.2 mt -70.98 -41.75 76.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.188 178.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.889 ' O ' HD12 ' A' ' 62' ' ' LEU . 29.7 t -58.53 -52.1 67.07 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.519 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.951 HD12 HD22 ' A' ' 31' ' ' LEU . 36.8 mt -61.5 -52.64 58.73 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.661 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.422 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 1.4 t70 -56.55 -34.84 67.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.311 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.79 -49.22 78.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.852 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.889 HD12 ' O ' ' A' ' 58' ' ' SER . 1.3 mp -55.62 -56.56 18.87 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.041 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.428 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.73 -54.44 7.89 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.762 0.315 . . . . 0.0 110.841 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.12 -24.44 66.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.918 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.481 ' O ' HG23 ' A' ' 69' ' ' THR . 10.1 mtmt -82.2 -30.06 31.09 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.223 0.535 . . . . 0.0 110.57 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.648 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -72.29 -33.74 47.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.983 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.0 mmtt -89.53 -24.11 21.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.051 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.548 ' O ' HG22 ' A' ' 69' ' ' THR . 58.3 m -115.38 19.08 15.74 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.548 HG22 ' O ' ' A' ' 68' ' ' SER . 0.1 OUTLIER -163.08 166.46 23.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.588 179.196 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -107.3 43.72 1.15 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.567 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -53.71 142.18 24.17 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.174 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.4 m -79.22 148.97 32.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.774 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.77 -31.15 68.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.594 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -59.22 -45.39 91.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.443 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -34.33 75.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.421 179.551 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.675 ' CD1' HD23 ' A' ' 62' ' ' LEU . 23.3 mm -71.49 -33.96 51.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.72 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -63.88 -51.75 63.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.783 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -60.94 -47.09 88.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.743 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -56.44 -33.17 65.6 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.877 ' O ' HG23 ' A' ' 84' ' ' VAL . 4.6 t80 -64.32 -37.71 88.46 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -69.9 -37.67 76.05 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.15 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.32 -33.54 72.53 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 121.114 0.483 . . . . 0.0 109.873 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.691 HD12 ' HA ' ' A' ' 80' ' ' TYR . 4.7 mt -77.77 -30.96 51.7 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.05 178.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.877 HG23 ' O ' ' A' ' 80' ' ' TYR . 52.7 t -69.42 -38.19 76.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.746 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.408 ' O ' ' HG2' ' A' ' 88' ' ' GLU . 0.8 OUTLIER -72.34 -46.93 53.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.732 179.761 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 m -68.94 -36.6 78.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.941 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.509 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 58.9 m -69.94 -51.12 35.36 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.039 -179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 12.2 pt-20 -55.39 -42.95 74.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.947 0.403 . . . . 0.0 110.797 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.402 ' N ' ' HG3' ' A' ' 88' ' ' GLU . 37.8 t70 -71.31 -28.23 63.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.849 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.786 HD23 HD23 ' A' ' 91' ' ' LEU . 1.5 tt -68.22 -50.21 55.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.297 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.786 HD23 HD23 ' A' ' 90' ' ' LEU . 5.8 mt -63.76 -41.57 97.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.361 0.6 . . . . 0.0 109.715 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.7 m -56.55 -39.79 74.01 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.767 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.417 ' O ' ' HG3' ' A' ' 97' ' ' LYS . . . -66.83 -54.32 23.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.344 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.417 ' CD2' ' O ' ' A' ' 90' ' ' LEU . 0.3 OUTLIER -63.88 -25.93 68.38 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.798 179.83 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -40.03 77.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.96 0.409 . . . . 0.0 110.128 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.1 mtpt -64.14 -43.52 94.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.012 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.417 ' HG3' ' O ' ' A' ' 93' ' ' ALA . 12.9 mttm -57.18 -47.34 81.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.952 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.776 ' HB3' HD22 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -75.78 -28.96 58.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.059 -179.801 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -70.83 -41.8 71.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.752 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -78.09 -28.99 48.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.107 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -90.7 46.24 1.32 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.147 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -161.94 -64.88 0.05 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.689 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.655 179.669 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.888 0.375 . . . . 0.0 110.995 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -177.62 56.56 0.1 OUTLIER Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.577 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.655 ' HA ' HD12 ' A' ' 21' ' ' LEU . 72.6 Cg_endo -76.39 -177.77 3.96 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.686 2.257 . . . . 0.0 112.433 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 112.38 -43.48 1.71 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.616 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.7 t -104.25 -20.67 13.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.689 0.28 . . . . 0.0 111.183 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.689 ' HG ' HG21 ' A' ' 66' ' ' ILE . 0.7 OUTLIER -54.84 -32.91 61.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.206 -179.914 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.5 t -61.97 -52.57 58.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.173 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.69 -45.53 63.52 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.936 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.567 ' CG1' HG23 ' A' ' 59' ' ' ILE . 30.6 t -60.1 -48.53 87.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.719 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.76 -39.71 98.29 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.011 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.1 m -56.7 -42.15 78.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.022 0.439 . . . . 0.0 110.236 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.744 HD23 HD13 ' A' ' 83' ' ' LEU . 20.1 tp -64.71 -41.35 96.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.145 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.7 ttmm -52.81 -39.35 62.32 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -65.05 -42.37 94.32 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.423 178.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.36 -31.6 72.8 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.824 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.629 HD21 HG22 ' A' ' 52' ' ' ILE . 3.3 tt -61.97 -50.37 72.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.068 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -57.74 -38.83 76.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.164 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -57.89 -44.59 86.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.251 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.785 ' O ' HG23 ' A' ' 38' ' ' VAL . 23.5 m-85 -59.71 -43.19 94.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.394 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -56.48 -40.61 75.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.397 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.88 -52.07 66.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.278 179.488 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.2 t -59.76 -37.79 73.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.497 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.892 HG22 HD21 ' A' ' 94' ' ' LEU . 60.3 t -67.47 -43.86 87.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.802 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.8 m -61.95 -29.22 70.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.443 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.28 -31.43 71.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.845 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.599 ' O ' HD12 ' A' ' 41' ' ' LEU . 1.3 pp -113.84 79.1 1.21 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.026 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 43' ' ' ASP . 6.4 mmtp -46.55 99.23 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.91 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' A' ' 42' ' ' LYS . 33.9 t0 178.22 146.62 0.14 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.919 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.625 ' O ' HG12 ' A' ' 48' ' ' VAL . . . 50.79 42.2 45.42 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.706 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.58 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 7.8 mmtp -59.39 -51.62 80.06 Favored Pre-proline 0 C--N 1.329 -0.303 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.58 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 28.9 Cg_endo -63.78 -42.52 19.75 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.201 1.934 . . . . 0.0 112.943 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -65.15 -50.55 65.54 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.823 0.344 . . . . 0.0 111.193 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.625 HG12 ' O ' ' A' ' 44' ' ' GLY . 14.5 p -63.51 -55.23 24.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.598 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.592 ' HA ' HG13 ' A' ' 52' ' ' ILE . 60.3 m-20 -51.58 -31.2 23.8 Favored 'General case' 0 N--CA 1.461 0.116 0 CA-C-O 120.867 0.365 . . . . 0.0 110.702 179.385 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.09 -44.77 83.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.322 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -70.95 -48.7 51.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.269 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.698 ' HA ' HD12 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -57.46 -41.1 78.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.031 179.442 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.564 ' HD3' HD11 ' A' ' 57' ' ' ILE . 1.1 tttt -58.36 -52.43 65.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.684 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.899 ' HA ' HD12 ' A' ' 57' ' ' ILE . 4.0 m120 -52.04 -39.81 60.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.944 0.402 . . . . 0.0 110.512 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.88 HD21 ' HB3' ' A' ' 86' ' ' SER . 10.5 mt -68.39 -44.44 75.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.594 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.65 -36.38 69.46 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.899 HD12 ' HA ' ' A' ' 54' ' ' ASN . 10.5 mt -71.35 -42.48 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.289 178.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.746 ' O ' HD12 ' A' ' 62' ' ' LEU . 2.8 m -60.4 -52.23 66.13 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.566 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.567 HG23 ' CG1' ' A' ' 24' ' ' VAL . 6.9 mt -58.13 -50.43 78.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.86 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -59.33 -37.16 77.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.813 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.66 -50.0 74.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.997 0.427 . . . . 0.0 110.676 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.746 HD12 ' O ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -55.72 -55.44 32.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.547 179.372 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.431 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -44.9 -54.61 6.27 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.263 -179.848 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.78 -25.93 66.9 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.678 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.55 ' HA ' HG23 ' A' ' 69' ' ' THR . 3.6 mtmp? -82.11 -29.49 31.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.024 0.44 . . . . 0.0 110.697 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.689 HG21 ' HG ' ' A' ' 21' ' ' LEU . 1.3 mm -73.12 -33.94 43.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.28 -179.293 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 14.3 mmtm -93.03 1.02 57.48 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.514 ' O ' HG22 ' A' ' 69' ' ' THR . 17.0 m -147.23 21.76 1.21 Allowed 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.55 HG23 ' HA ' ' A' ' 65' ' ' LYS . 0.2 OUTLIER -161.85 158.6 25.75 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.752 179.362 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -97.39 43.52 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.318 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.4 129.13 21.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.341 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.427 HG22 ' H ' ' A' ' 74' ' ' GLU . 12.4 m -71.36 137.83 48.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.578 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.84 -30.29 22.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.717 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.427 ' H ' HG22 ' A' ' 72' ' ' THR . 1.1 tt0 -59.34 -43.92 92.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.377 179.511 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 15.1 tp60 -68.05 -33.97 75.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.417 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.655 ' CD1' HD23 ' A' ' 62' ' ' LEU . 22.8 mm -69.58 -39.46 78.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.498 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -41.35 96.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.669 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.25 -48.24 68.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.453 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -56.57 -34.25 66.96 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.858 ' O ' HG23 ' A' ' 84' ' ' VAL . 52.5 t80 -65.04 -36.81 85.55 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.407 -0.961 . . . . 0.0 108.407 177.595 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -69.84 -37.62 76.24 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.775 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.94 -33.61 72.13 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.744 HD13 HD23 ' A' ' 27' ' ' LEU . 2.0 mt -76.88 -32.39 57.44 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.105 179.007 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.858 HG23 ' O ' ' A' ' 80' ' ' TYR . 43.2 t -69.52 -36.66 72.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.495 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.404 ' O ' ' HG3' ' A' ' 88' ' ' GLU . 4.4 mmtm -72.13 -42.66 65.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.566 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.88 ' HB3' HD21 ' A' ' 55' ' ' LEU . 0.3 OUTLIER -73.91 -35.65 64.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.492 179.587 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.431 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 34.8 m -68.59 -50.61 50.32 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.645 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 85' ' ' LYS . 1.6 pp20? -60.19 -38.7 84.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.323 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -65.85 -32.86 74.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.235 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.535 HD23 ' C ' ' A' ' 90' ' ' LEU . 5.7 tt -64.66 -44.07 91.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.667 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.0 mt -62.09 -43.54 98.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.789 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 57.9 m -54.66 -46.68 74.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.449 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.3 -40.71 97.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.415 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.892 HD21 HG22 ' A' ' 38' ' ' VAL . 1.3 mp -57.72 -49.75 75.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.56 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.83 -42.33 75.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.592 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.13 -38.6 80.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.571 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.47 ' HA ' ' HG2' ' A' ' 100' ' ' GLN . 7.2 mttt -62.13 -46.12 90.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.371 0.605 . . . . 0.0 111.069 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -65.06 -53.55 43.98 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.661 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -63.73 -32.14 73.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.055 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.47 ' HG2' ' HA ' ' A' ' 97' ' ' LYS . 3.8 pt20 -79.65 -39.75 30.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.77 0.319 . . . . 0.0 111.185 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -68.88 -56.85 6.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.026 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 61.04 116.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.881 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.337 -179.646 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.83 0.348 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 122.38 164.58 12.21 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.532 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.35 138.81 36.78 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.699 2.266 . . . . 0.0 112.302 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -176.16 44.91 0.11 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.308 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.2 p -178.28 -38.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.872 0.368 . . . . 0.0 110.829 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.5 ' HG ' HG21 ' A' ' 66' ' ' ILE . 13.6 mt -54.6 -32.76 59.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.95 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.504 HG13 ' N ' ' A' ' 23' ' ' LYS . 9.9 p -59.13 -47.06 91.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.022 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.504 ' N ' HG13 ' A' ' 22' ' ' VAL . 5.6 tttt -61.54 -41.98 98.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.077 0.465 . . . . 0.0 110.3 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.564 ' CG1' HG23 ' A' ' 59' ' ' ILE . 40.8 t -57.03 -44.88 83.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.49 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.17 -37.69 94.92 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.711 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.44 -44.57 84.82 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.895 0.378 . . . . 0.0 110.222 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.679 HD23 HD13 ' A' ' 83' ' ' LEU . 20.0 tp -62.65 -41.79 99.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.088 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.3 tptt -53.28 -38.5 63.15 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.9 mptt -65.15 -40.67 94.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.32 178.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.453 ' HD3' HD12 ' A' ' 27' ' ' LEU . 60.8 mtp180 -63.44 -31.32 72.45 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.739 178.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.518 HD13 ' CD1' ' A' ' 59' ' ' ILE . 0.2 OUTLIER -63.09 -49.09 75.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.103 179.143 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -59.48 -37.0 77.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.315 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -50.24 73.56 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.332 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.89 ' O ' HG23 ' A' ' 38' ' ' VAL . 4.1 m-85 -58.78 -45.51 89.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.619 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -51.56 -43.8 62.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.02 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -61.43 -53.92 50.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.566 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 33.5 t -58.63 -37.7 66.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.767 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 1.116 HG22 HD21 ' A' ' 94' ' ' LEU . 39.3 t -71.08 -40.46 75.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.081 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.44 -38.39 77.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.86 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.32 -20.05 63.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.436 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.85 HD12 ' HA ' ' A' ' 38' ' ' VAL . 44.4 mt -75.33 -42.48 54.29 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.211 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.61 14.0 7.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.439 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -131.68 146.53 52.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.704 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.712 ' O ' HG12 ' A' ' 48' ' ' VAL . . . 57.22 27.93 58.22 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.334 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.799 ' HE3' HG12 ' A' ' 38' ' ' VAL . 0.6 OUTLIER -61.92 -49.33 86.08 Favored Pre-proline 0 C--N 1.329 -0.313 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.716 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.633 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 10.8 Cg_endo -55.0 -45.48 40.59 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.146 1.897 . . . . 0.0 112.954 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 50' ' ' ARG . 11.8 pt-20 -70.06 -50.73 38.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.768 0.318 . . . . 0.0 111.479 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.712 HG12 ' O ' ' A' ' 44' ' ' GLY . 8.3 p -62.04 -55.29 25.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.718 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.572 ' HA ' HG13 ' A' ' 52' ' ' ILE . 98.2 m-20 -51.59 -43.79 62.58 Favored 'General case' 0 N--CA 1.463 0.204 0 O-C-N 123.078 0.236 . . . . 0.0 111.399 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.514 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -60.78 -36.04 77.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.773 0.32 . . . . 0.0 110.682 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.514 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 44.6 mt-30 -74.42 -48.57 26.87 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.219 0.533 . . . . 0.0 109.973 179.366 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.861 ' HA ' HD12 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -57.56 -38.86 66.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.923 179.319 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.411 ' O ' HG13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -61.45 -53.2 59.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.597 179.507 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.922 ' HA ' HD12 ' A' ' 57' ' ' ILE . 5.3 m120 -51.54 -36.52 45.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.786 0.327 . . . . 0.0 110.724 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.861 HD12 ' HA ' ' A' ' 52' ' ' ILE . 2.7 mt -72.93 -45.54 57.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.82 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.772 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.4 OUTLIER -56.74 -33.11 66.23 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.779 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.922 HD12 ' HA ' ' A' ' 54' ' ' ASN . 14.5 mt -71.26 -44.19 73.51 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.188 178.311 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.721 ' O ' HD12 ' A' ' 62' ' ' LEU . 8.1 m -59.11 -46.67 87.71 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.377 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.772 HD12 ' HA ' ' A' ' 56' ' ' GLU . 5.7 mt -58.46 -55.07 24.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.732 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -57.9 -33.73 69.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.543 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.84 -49.97 74.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.206 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.721 HD12 ' O ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -55.89 -54.64 42.14 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.264 179.045 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.426 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.03 -54.95 6.04 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.255 179.914 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.27 -25.17 66.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.649 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 24.1 mtpt -82.29 -29.97 30.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.166 0.508 . . . . 0.0 110.62 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -71.99 -34.06 49.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.092 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.64 1.16 55.56 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.238 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.45 ' O ' HG22 ' A' ' 69' ' ' THR . 58.3 m -138.87 21.91 2.65 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.45 HG22 ' O ' ' A' ' 68' ' ' SER . 1.3 p -160.16 179.61 8.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.869 0.366 . . . . 0.0 110.73 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.58 37.36 3.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.565 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 16.7 mmm -56.0 146.18 23.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.125 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.2 m -84.97 142.41 29.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.755 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.99 -29.81 57.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.707 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -46.39 89.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.451 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.46 -34.23 75.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.436 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.639 ' CD1' HD23 ' A' ' 62' ' ' LEU . 27.0 mm -70.58 -33.87 55.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.77 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 8.4 tp60 -66.46 -42.65 87.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.872 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.59 -50.9 56.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.72 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -56.37 -34.09 66.33 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.916 ' O ' HG23 ' A' ' 84' ' ' VAL . 64.9 t80 -64.55 -35.65 81.66 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -69.55 -37.52 77.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.963 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.25 -37.27 77.15 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.313 0.578 . . . . 0.0 109.589 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.679 HD13 HD23 ' A' ' 27' ' ' LEU . 26.3 mt -75.51 -30.71 59.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.101 178.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.916 HG23 ' O ' ' A' ' 80' ' ' TYR . 61.7 t -69.17 -34.57 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.53 179.347 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.16 -49.11 38.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.464 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 m -68.1 -36.85 80.45 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.568 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.0 t -66.64 -50.33 63.3 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.811 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.4 ' HG3' ' N ' ' A' ' 89' ' ' ASP . 8.7 pt-20 -58.79 -36.0 73.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.487 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.4 ' N ' ' HG3' ' A' ' 88' ' ' GLU . 0.8 OUTLIER -70.19 -31.42 68.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.73 179.649 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.414 HD23 HD23 ' A' ' 91' ' ' LEU . 6.5 tt -66.34 -49.05 68.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.993 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.678 HD21 ' CE1' ' A' ' 34' ' ' PHE . 7.0 mt -60.71 -49.09 78.89 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.143 0.497 . . . . 0.0 109.848 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.2 m -55.73 -42.72 75.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.662 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.77 -52.25 63.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.685 179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 1.116 HD21 HG22 ' A' ' 38' ' ' VAL . 4.6 mp -57.45 -42.68 82.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.756 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.414 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -55.59 -43.88 76.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.611 179.717 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.7 mtmt -66.35 -29.64 69.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.031 0.443 . . . . 0.0 109.835 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -71.29 -53.2 15.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.458 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.453 ' HD2' HD21 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -61.19 -45.57 94.05 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.152 -179.54 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLN . . . . . 0.406 ' HG3' ' N ' ' A' ' 100' ' ' GLN . 19.2 pt20 -59.44 -42.54 92.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.743 0.306 . . . . 0.0 110.69 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.406 ' N ' ' HG3' ' A' ' 99' ' ' GLN . 27.4 mt-30 -69.72 -36.03 75.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.504 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 45.29 27.65 0.37 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.834 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 61.07 116.9 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.043 0.449 . . . . 0.0 111.036 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 . . . . . 0 C--N 1.321 -0.644 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.441 -179.825 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.873 0.368 . . . . 0.0 110.996 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.45 -101.72 1.9 Allowed Glycine 0 CA--C 1.519 0.331 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.614 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.73 163.0 39.7 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.495 2.13 . . . . 0.0 112.339 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.422 ' O ' HG12 ' A' ' 22' ' ' VAL . . . 139.64 -69.92 0.47 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.587 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.4 p -93.12 -25.05 18.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.769 0.319 . . . . 0.0 111.14 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.455 HD23 ' HA ' ' A' ' 63' ' ' MET . 2.9 mt -54.69 -32.89 60.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.161 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.501 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.0 p -63.98 -46.5 93.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.412 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.501 ' N ' HG13 ' A' ' 22' ' ' VAL . 47.8 mttm -56.73 -50.52 71.96 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.019 0.438 . . . . 0.0 110.674 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 1.034 HG12 HG23 ' A' ' 59' ' ' ILE . 3.5 t -57.04 -39.96 69.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.116 179.499 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.1 -37.15 93.81 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.595 179.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.1 m -57.02 -47.28 81.28 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.078 0.466 . . . . 0.0 110.084 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.497 HD11 ' HB2' ' A' ' 83' ' ' LEU . 4.1 tt -61.53 -38.7 88.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.818 179.032 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.463 ' HB2' HG21 ' A' ' 59' ' ' ILE . 6.5 tttt -54.92 -37.8 66.84 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 178.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.0 -41.85 95.0 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.33 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.26 -30.48 71.62 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.795 178.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.555 HD13 ' CD1' ' A' ' 59' ' ' ILE . 0.3 OUTLIER -63.0 -52.35 63.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.101 179.312 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -57.93 -36.06 71.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.076 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.417 ' O ' HG23 ' A' ' 37' ' ' VAL . 0.1 OUTLIER -58.99 -44.55 91.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.244 179.305 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.857 ' O ' HG23 ' A' ' 38' ' ' VAL . 13.1 m-85 -61.18 -43.37 98.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.346 179.531 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.8 m-20 -54.09 -44.67 71.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.534 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -59.26 -54.32 48.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.062 0.458 . . . . 0.0 110.439 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 33' ' ' LYS . 22.4 t -55.89 -37.78 49.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.49 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.857 HG23 ' O ' ' A' ' 34' ' ' PHE . 48.8 t -69.58 -40.86 80.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.618 179.43 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.8 t -63.72 -23.29 67.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.334 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.05 -38.75 92.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.564 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.605 HD21 ' HA ' ' A' ' 38' ' ' VAL . 0.5 OUTLIER -88.81 -34.23 17.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.682 0.277 . . . . 0.0 111.23 -179.836 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.86 10.02 6.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.756 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.432 ' H ' HD12 ' A' ' 41' ' ' LEU . 5.1 t0 -103.76 103.28 13.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.78 0.324 . . . . 0.0 111.071 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.715 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 101.11 53.67 1.0 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.575 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.52 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 2.2 mmtt -66.69 -57.27 12.28 Favored Pre-proline 0 C--N 1.327 -0.388 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 13.8 Cg_endo -56.88 -49.47 14.39 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.47 2.113 . . . . 0.0 112.974 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.27 -50.14 72.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.826 0.346 . . . . 0.0 111.213 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.765 HG11 HG11 ' A' ' 38' ' ' VAL . 50.7 t -64.59 -55.57 20.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.706 179.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.446 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 85.3 m-20 -55.46 -25.57 37.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.092 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.32 -49.44 34.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.861 0.362 . . . . 0.0 111.585 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -76.62 -44.56 33.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.492 0.663 . . . . 0.0 109.753 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.767 ' HA ' HD12 ' A' ' 55' ' ' LEU . 1.8 mt -57.62 -35.34 50.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.337 179.096 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.504 ' HG3' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -69.4 -51.71 33.91 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.591 179.283 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.94 ' HA ' HD12 ' A' ' 57' ' ' ILE . 5.1 m120 -50.99 -34.46 29.2 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.712 0.291 . . . . 0.0 110.513 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.767 HD12 ' HA ' ' A' ' 52' ' ' ILE . 1.7 mt -75.81 -43.49 45.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.315 179.275 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.832 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -56.86 -36.41 70.01 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.551 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.94 HD12 ' HA ' ' A' ' 54' ' ' ASN . 12.2 mt -68.51 -40.73 82.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 114.937 -1.028 . . . . 0.0 109.946 178.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.74 ' O ' HD12 ' A' ' 62' ' ' LEU . 9.8 m -57.48 -45.62 84.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.482 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 1.034 HG23 HG12 ' A' ' 24' ' ' VAL . 4.6 mt -60.23 -50.72 79.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.398 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.436 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 72.7 m-20 -57.08 -31.68 65.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.166 179.246 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -63.25 -49.32 74.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.672 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.74 HD12 ' O ' ' A' ' 58' ' ' SER . 1.6 mp -56.16 -56.99 14.17 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.023 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.455 ' HA ' HD23 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -46.44 -50.72 16.4 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.7 0.286 . . . . 0.0 110.841 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.07 -24.44 67.7 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.753 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.9 mtpt -82.45 -29.36 30.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.113 0.482 . . . . 0.0 110.557 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.654 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -73.07 -37.13 52.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.201 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 5.5 mmmt -93.96 -27.46 16.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.542 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.767 ' O ' HG23 ' A' ' 69' ' ' THR . 1.2 t -105.67 24.96 11.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.699 0.285 . . . . 0.0 111.411 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.767 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 174.66 155.06 0.14 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.887 179.746 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 5.9 mtm -107.73 69.27 0.73 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.907 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.64 ' SD ' HD11 ' A' ' 76' ' ' ILE . 9.2 ptm -72.11 173.29 8.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.791 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.43 141.96 28.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.066 -179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.08 -29.89 67.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.714 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -58.01 -40.25 80.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.725 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -35.04 79.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.52 179.659 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.663 ' CD1' HD23 ' A' ' 62' ' ' LEU . 27.0 mm -67.96 -37.54 78.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.833 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 4.0 tp60 -66.68 -52.12 48.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.853 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -45.67 85.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.731 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -56.56 -35.13 67.81 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.912 ' O ' HG23 ' A' ' 84' ' ' VAL . 11.2 t80 -64.21 -38.08 89.76 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 177.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -69.97 -35.79 74.72 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.09 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.42 79.2 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.242 0.544 . . . . 0.0 109.75 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.497 ' HB2' HD11 ' A' ' 27' ' ' LEU . 6.5 mt -74.45 -31.25 62.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.045 178.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.912 HG23 ' O ' ' A' ' 80' ' ' TYR . 61.4 t -69.57 -38.99 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.356 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -66.13 -49.14 68.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.377 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 74.7 m -68.27 -38.06 81.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.407 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.437 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 24.3 m -65.7 -50.37 65.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.692 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.89 -43.58 73.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.985 0.421 . . . . 0.0 110.728 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -67.56 -29.12 68.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.707 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.494 HD23 HD23 ' A' ' 91' ' ' LEU . 6.1 tt -67.92 -48.89 64.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.064 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.617 HD21 ' CD1' ' A' ' 34' ' ' PHE . 7.0 mt -61.03 -52.44 64.94 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.057 0.456 . . . . 0.0 110.076 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.4 m -58.58 -38.32 77.66 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.662 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.25 -36.06 76.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.875 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.511 HD21 HG13 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -70.23 -42.42 72.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.856 179.904 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.47 ' HA ' ' HD3' ' A' ' 98' ' ' LYS . 0.1 OUTLIER -59.01 -54.25 49.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.686 179.825 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.6 mtpp -63.78 -28.9 70.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.37 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.5 tttp -67.14 -34.57 77.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.161 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.47 ' HD3' ' HA ' ' A' ' 95' ' ' GLN . 0.2 OUTLIER -74.95 -53.87 8.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.887 0.375 . . . . 0.0 111.104 -179.901 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.68 -26.37 67.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.557 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -78.88 -53.05 7.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.096 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 58.92 -86.23 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.57 -179.618 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -158.72 98.57 1.51 Allowed 'General case' 0 CA--C 1.52 -0.173 0 CA-C-O 120.979 0.419 . . . . 0.0 110.549 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 C--N 1.323 -0.567 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.598 179.573 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 . . . . . 0 N--CA 1.457 -0.085 0 CA-C-O 120.873 0.368 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -156.94 -177.89 30.49 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.543 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.19 -167.73 0.26 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.591 2.194 . . . . 0.0 112.338 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.79 -42.46 1.91 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.376 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.583 ' OG ' HG21 ' A' ' 76' ' ' ILE . 40.2 t -109.74 -35.28 6.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.831 0.348 . . . . 0.0 110.799 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.5 -32.73 72.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.933 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.517 HG13 ' N ' ' A' ' 23' ' ' LYS . 11.5 p -61.18 -47.98 91.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.254 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.517 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -59.45 -37.91 79.36 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.912 0.387 . . . . 0.0 110.589 179.666 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 20' ' ' SER . 19.8 t -58.67 -50.61 78.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.395 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.15 -40.45 97.23 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.644 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.644 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -57.02 -37.99 72.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.08 0.466 . . . . 0.0 110.022 179.292 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.818 HD22 HD13 ' A' ' 83' ' ' LEU . 0.7 OUTLIER -64.97 -42.83 94.23 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 178.932 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.75 -35.78 56.74 Favored 'General case' 0 C--N 1.333 -0.128 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.187 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.644 ' HG3' ' HA ' ' A' ' 26' ' ' THR . 23.2 mttt -61.69 -45.64 93.1 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.592 178.01 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -36.96 71.55 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.316 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.402 HD23 ' HB3' ' A' ' 56' ' ' GLU . 6.1 mp -61.36 -51.2 69.8 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.491 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -57.94 -37.04 73.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.296 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.434 ' O ' HG23 ' A' ' 37' ' ' VAL . 3.8 tptt -58.86 -43.2 90.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.263 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.814 ' O ' HG23 ' A' ' 38' ' ' VAL . 13.0 m-85 -63.91 -41.39 97.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.612 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 45.5 m-20 -55.19 -44.19 75.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.872 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -62.72 -54.29 41.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.766 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 33' ' ' LYS . 33.7 t -57.71 -38.22 63.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.06 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.891 HG21 HG11 ' A' ' 48' ' ' VAL . 47.9 t -75.07 -35.45 34.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.885 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.4 p -60.78 -34.02 73.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.531 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.11 -21.42 59.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.269 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' A' ' 38' ' ' VAL . 77.5 mt -71.45 -41.28 69.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.93 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.67 13.81 7.66 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.567 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -131.06 135.56 47.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.92 0.391 . . . . 0.0 110.898 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.549 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 59.05 57.27 20.73 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.488 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.498 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 3.7 mmmm -77.45 -45.09 2.62 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 120.508 0.194 . . . . 0.0 111.348 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.498 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 50.2 Cg_exo -53.68 -42.36 66.75 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.256 1.971 . . . . 0.0 112.475 -179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -60.64 -50.23 74.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.921 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.891 HG11 HG21 ' A' ' 38' ' ' VAL . 5.1 t -65.92 -55.21 20.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.082 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.6 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 97.4 m-20 -52.85 -31.11 37.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.362 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 26.4 ttm180 -73.06 -47.89 40.74 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -73.01 -41.27 64.44 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.621 0.724 . . . . 0.0 109.41 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.618 HG13 HG12 ' A' ' 48' ' ' VAL . 1.4 mt -61.87 -31.54 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.082 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.6 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -70.16 -55.05 10.35 Favored 'General case' 0 N--CA 1.46 0.055 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.366 179.54 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.961 ' HA ' HD12 ' A' ' 57' ' ' ILE . 28.5 p30 -59.83 -25.42 64.98 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.989 -179.512 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 71.9 mt -77.54 -46.74 21.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.514 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.541 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -57.0 -32.88 66.57 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.957 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.961 HD12 ' HA ' ' A' ' 54' ' ' ASN . 13.6 mt -71.4 -41.43 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.063 178.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.558 ' O ' HD12 ' A' ' 62' ' ' LEU . 69.1 m -57.46 -47.6 81.42 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.214 179.435 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.541 HD12 ' HA ' ' A' ' 56' ' ' GLU . 11.7 mt -59.78 -49.83 82.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.271 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.79 -32.58 71.92 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.114 179.265 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -57.83 -49.86 75.22 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.96 179.182 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.642 ' O ' HG12 ' A' ' 66' ' ' ILE . 0.8 OUTLIER -55.72 -53.62 54.41 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.2 178.89 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.432 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.28 -56.44 4.87 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.018 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.62 -24.07 65.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.607 179.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.07 -29.19 31.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.233 0.539 . . . . 0.0 110.415 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.642 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.8 mm -73.46 -41.11 56.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.499 -179.302 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.75 -29.51 16.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.875 -179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.765 ' O ' HG23 ' A' ' 69' ' ' THR . 0.8 OUTLIER -102.32 24.23 10.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.693 0.282 . . . . 0.0 111.713 -179.387 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.765 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 177.57 149.82 0.18 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.935 179.523 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.4 mtm -76.06 63.22 1.77 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.957 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.51 125.77 25.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.788 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.1 m -78.11 135.54 37.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.799 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.86 -33.71 50.98 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.871 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.39 -47.51 83.64 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.347 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.15 -32.92 74.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.353 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.629 ' CD1' HD23 ' A' ' 62' ' ' LEU . 26.1 mm -71.58 -38.69 68.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.695 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -52.18 66.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.634 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.58 -47.04 80.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.485 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -56.54 -34.06 66.71 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.907 ' O ' HG23 ' A' ' 84' ' ' VAL . 16.2 t80 -64.24 -37.26 86.86 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -69.67 -36.7 76.26 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.978 178.545 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.49 -36.07 75.34 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.146 0.498 . . . . 0.0 109.688 179.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.818 HD13 HD22 ' A' ' 27' ' ' LEU . 5.2 mt -76.74 -31.25 56.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.004 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.907 HG23 ' O ' ' A' ' 80' ' ' TYR . 54.0 t -69.55 -34.83 63.49 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.466 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.8 tptp -71.99 -49.26 38.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.408 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 11.6 m -66.71 -43.7 83.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.406 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 98.5 p -61.51 -48.46 80.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.505 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -55.28 -41.04 71.73 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.702 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.98 -34.36 78.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.602 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 tt -63.36 -46.3 87.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.791 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.765 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.3 mt -63.75 -47.47 80.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.129 0.49 . . . . 0.0 109.825 179.431 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 33.8 p -56.52 -39.51 73.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.564 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.99 -47.03 75.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.592 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 85.7 mt -57.2 -44.78 83.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.632 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.421 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 0.5 OUTLIER -59.82 -39.85 86.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.368 179.46 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.4 mttt -64.22 -29.15 70.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.853 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.4 -58.46 3.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.309 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 0.0 OUTLIER -58.26 -48.01 81.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.314 -179.45 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -60.15 -38.06 81.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.843 0.354 . . . . 0.0 110.771 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -62.64 -37.4 86.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.745 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -132.21 96.88 3.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.874 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -67.59 -26.32 66.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.043 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.361 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 . . . . . 0 C--O 1.233 0.216 0 CA-C-O 120.823 0.344 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 167.03 -95.01 0.11 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.422 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.58 -167.87 0.36 Allowed 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.519 2.146 . . . . 0.0 112.262 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.531 ' O ' HG12 ' A' ' 22' ' ' VAL . . . 104.27 -41.21 2.2 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.519 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 p -87.83 -23.19 24.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.84 0.352 . . . . 0.0 111.178 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.471 ' HG ' HG21 ' A' ' 66' ' ' ILE . 20.4 mt -54.01 -33.0 55.96 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.074 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.531 HG12 ' O ' ' A' ' 19' ' ' GLY . 12.3 p -60.78 -45.91 97.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.042 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.501 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -60.44 -46.81 88.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.058 0.456 . . . . 0.0 110.587 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.535 HG13 HG23 ' A' ' 59' ' ' ILE . 19.4 t -56.97 -44.78 83.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.419 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.89 -36.41 92.78 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.707 -0.759 . . . . 0.0 111.68 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.3 m -57.98 -47.51 82.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.913 0.387 . . . . 0.0 110.186 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.768 HD13 HD13 ' A' ' 83' ' ' LEU . 12.8 mt -60.84 -39.04 87.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.078 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.483 ' HA ' HD12 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -54.55 -40.62 68.88 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.589 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.57 -37.23 86.84 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.387 178.487 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.405 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -62.04 -33.4 74.3 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.726 178.979 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 1.006 HD11 HD12 ' A' ' 59' ' ' ILE . 64.4 mt -65.26 -48.86 71.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.022 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -57.75 -42.06 83.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.195 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.4 tptt -61.08 -41.93 97.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.047 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.829 ' CZ ' HD21 ' A' ' 91' ' ' LEU . 4.0 m-30 -60.73 -45.44 94.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.366 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 12.6 m-20 -58.65 -36.45 74.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.615 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -61.42 -55.29 32.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.479 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 36.6 t -58.97 -37.93 70.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.67 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.87 HG21 HG11 ' A' ' 48' ' ' VAL . 46.3 t -70.82 -37.79 70.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.871 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.56 -36.88 79.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.426 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.34 -12.77 60.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.387 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.532 HD12 ' HA ' ' A' ' 38' ' ' VAL . 52.3 mt -85.98 -55.52 3.91 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.965 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.13 3.73 4.44 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.649 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -114.09 126.64 55.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.781 0.324 . . . . 0.0 110.692 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.772 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 75.89 31.93 54.59 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.326 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.535 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 6.8 mmtt -48.1 -57.31 10.72 Favored Pre-proline 0 C--N 1.331 -0.236 0 N-CA-C 111.606 0.224 . . . . 0.0 111.606 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 10.6 Cg_endo -54.1 -49.19 17.9 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.524 2.149 . . . . 0.0 112.513 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -53.34 -49.71 66.55 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.017 0.437 . . . . 0.0 111.264 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.87 HG11 HG21 ' A' ' 38' ' ' VAL . 2.5 t -67.64 -55.23 17.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.92 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.567 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 79.5 m-20 -52.66 -35.7 55.48 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.494 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 11.6 ptt85 -73.65 -38.96 64.82 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.494 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 61.7 mt-30 -75.94 -47.75 23.95 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.731 0.777 . . . . 0.0 109.163 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.727 ' CD1' HG12 ' A' ' 48' ' ' VAL . 3.6 mt -57.03 -32.14 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 114.555 -1.202 . . . . 0.0 110.09 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.613 ' HD2' HD11 ' A' ' 57' ' ' ILE . 0.4 OUTLIER -69.13 -52.99 22.54 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.418 179.011 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.919 ' HA ' HD12 ' A' ' 57' ' ' ILE . 4.6 m120 -50.99 -34.31 28.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.875 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 51' ' ' GLN . 26.4 mt -76.0 -45.96 31.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.96 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.451 ' HG3' ' N ' ' A' ' 57' ' ' ILE . 0.4 OUTLIER -56.65 -31.91 64.83 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.915 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.919 HD12 ' HA ' ' A' ' 54' ' ' ASN . 16.8 mt -71.34 -44.79 72.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.055 178.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.603 ' O ' HD12 ' A' ' 62' ' ' LEU . 4.6 m -60.27 -52.41 65.39 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.355 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 1.006 HD12 HD11 ' A' ' 31' ' ' LEU . 71.6 mt -58.24 -51.43 71.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.585 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.16 -33.52 71.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.206 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -57.64 -49.49 76.28 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.962 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.657 ' O ' HG12 ' A' ' 66' ' ' ILE . 0.8 OUTLIER -55.33 -52.51 63.24 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.16 178.912 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.502 ' HE3' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -44.96 -58.55 3.08 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.02 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.24 -24.2 62.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.576 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.434 ' HA ' HG23 ' A' ' 69' ' ' THR . 0.2 OUTLIER -82.18 -29.66 31.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.141 0.496 . . . . 0.0 110.562 179.485 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.2 mm -70.49 -40.45 77.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.237 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.27 1.23 51.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.17 -179.155 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.478 ' O ' HG22 ' A' ' 69' ' ' THR . 1.5 m -132.95 21.18 4.13 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 120.748 -0.381 . . . . 0.0 112.018 -179.666 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.478 HG22 ' O ' ' A' ' 68' ' ' SER . 1.0 OUTLIER -160.34 -175.34 4.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.858 0.361 . . . . 0.0 110.833 179.32 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -126.55 33.42 4.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.392 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.1 mmm -56.91 149.98 17.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.999 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.7 m -80.67 143.94 32.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.904 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.81 -30.77 58.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.64 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -58.08 -46.26 85.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.39 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.06 -35.68 73.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.203 179.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.646 HG22 ' CE2' ' A' ' 80' ' ' TYR . 18.4 mm -69.54 -33.97 59.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.489 179.294 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 80' ' ' TYR . 8.0 tp-100 -61.83 -49.44 76.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.468 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 mmtt -62.59 -41.61 99.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.273 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -57.69 -36.22 71.67 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.905 ' O ' HG23 ' A' ' 84' ' ' VAL . 14.5 m-85 -64.32 -35.9 82.38 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 177.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -69.44 -37.58 77.43 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.026 178.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.46 -34.62 75.76 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.24 0.543 . . . . 0.0 109.61 178.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.768 HD13 HD13 ' A' ' 27' ' ' LEU . 54.4 mt -76.87 -30.26 56.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.06 178.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.905 HG23 ' O ' ' A' ' 80' ' ' TYR . 66.4 t -68.12 -35.76 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.41 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.7 tptt -72.44 -49.26 34.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.599 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.9 m -66.03 -43.11 88.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.518 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 96.3 p -62.38 -46.7 87.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.525 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -55.94 -41.26 74.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.634 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.96 -32.12 73.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.704 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.589 HD22 ' CD2' ' A' ' 34' ' ' PHE . 7.9 tt -63.97 -47.8 78.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.046 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.829 HD21 ' CZ ' ' A' ' 34' ' ' PHE . 7.6 mt -60.59 -52.55 64.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.109 0.481 . . . . 0.0 109.925 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 69.8 m -54.93 -38.63 67.91 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.487 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.435 ' HA ' ' HG2' ' A' ' 96' ' ' LYS . . . -68.93 -36.17 77.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.621 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.9 tp -66.29 -49.06 68.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.745 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.459 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 75.6 mm-40 -55.92 -48.92 74.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.613 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.435 ' HG2' ' HA ' ' A' ' 93' ' ' ALA . 9.0 pttt -62.84 -28.62 70.14 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.89 -55.39 13.02 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.599 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 0.1 OUTLIER -62.28 -44.08 97.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.605 -179.067 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLN . . . . . 0.416 ' HG2' ' HA ' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -66.42 -31.02 71.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.573 0.225 . . . . 0.0 111.065 -179.698 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -78.15 -52.67 8.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.778 0.323 . . . . 0.0 110.765 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -74.68 79.8 2.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.789 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -145.64 -47.0 0.21 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.933 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.929 179.93 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.903 0.382 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.93 108.82 1.2 Allowed Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.616 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.98 77.19 1.17 Allowed 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.406 2.071 . . . . 0.0 112.22 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -124.64 7.75 8.34 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.926 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.553 ' HB3' HG21 ' A' ' 76' ' ' ILE . 1.0 OUTLIER -112.29 -28.83 7.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.738 0.304 . . . . 0.0 111.025 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.778 ' HG ' HG21 ' A' ' 66' ' ' ILE . 5.0 mt -53.78 -32.84 53.97 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.061 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.49 HG13 ' N ' ' A' ' 23' ' ' LYS . 11.6 p -67.8 -45.15 84.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.97 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.49 ' N ' HG13 ' A' ' 22' ' ' VAL . 2.0 tppp? -63.43 -52.98 59.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.928 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.757 HG12 HG23 ' A' ' 59' ' ' ILE . 23.7 t -56.76 -46.97 83.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.578 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -58.83 -40.22 94.84 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.511 -0.852 . . . . 0.0 111.419 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.469 HG22 ' HE ' ' A' ' 30' ' ' ARG . 48.4 m -57.18 -38.96 74.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.063 0.459 . . . . 0.0 109.925 179.008 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.702 ' CD2' HD13 ' A' ' 83' ' ' LEU . 15.8 tp -62.84 -44.06 97.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.878 179.116 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.95 -39.6 63.03 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -36.2 83.55 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.582 178.412 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.469 ' HE ' HG22 ' A' ' 26' ' ' THR . 0.0 OUTLIER -65.62 -33.61 76.3 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.876 179.024 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.726 HD13 ' CD1' ' A' ' 59' ' ' ILE . 0.7 OUTLIER -64.96 -42.02 94.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.945 179.194 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.28 -49.39 77.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.832 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.5 ' O ' HG23 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -57.86 -35.78 71.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.823 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.829 ' O ' HG23 ' A' ' 38' ' ' VAL . 15.7 m-85 -65.62 -39.87 91.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.891 0.376 . . . . 0.0 110.411 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -61.33 -40.61 94.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.379 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -53.66 54.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.363 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 33' ' ' LYS . 22.6 t -57.54 -37.96 61.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.723 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.829 HG23 ' O ' ' A' ' 34' ' ' PHE . 77.2 t -71.18 -39.41 73.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.892 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.84 -37.16 75.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.74 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.76 -17.98 65.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.426 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.63 HD12 ' HA ' ' A' ' 38' ' ' VAL . 24.4 mt -79.93 -34.64 38.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.148 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER 64.77 12.69 7.87 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.476 -179.741 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -133.82 155.28 50.11 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.814 0.34 . . . . 0.0 110.766 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.854 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 57.8 27.79 59.6 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.32 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.524 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 1.1 mmtt -55.73 -57.21 22.69 Favored Pre-proline 0 C--N 1.329 -0.306 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 11.7 Cg_endo -55.69 -49.09 16.96 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.428 2.085 . . . . 0.0 112.68 -179.649 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 4.2 mt-10 -55.49 -48.95 73.78 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.069 0.461 . . . . 0.0 111.074 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.854 HG23 ' O ' ' A' ' 44' ' ' GLY . 18.8 t -67.19 -50.06 66.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.256 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.416 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 86.0 m-20 -59.06 -33.09 70.38 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.493 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 8.1 ptp180 -73.51 -40.21 64.21 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.442 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.493 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 31.7 mt-30 -75.98 -49.77 16.74 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.05 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.591 HG13 ' O ' ' A' ' 48' ' ' VAL . 2.0 mt -56.89 -29.91 32.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.005 178.537 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.473 ' HA ' ' HG2' ' A' ' 56' ' ' GLU . 32.2 tttt -69.26 -53.17 21.16 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.159 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.933 ' HA ' HD12 ' A' ' 57' ' ' ILE . 3.6 m120 -53.17 -32.39 47.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.843 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.563 ' HB2' HD21 ' A' ' 31' ' ' LEU . 55.6 mt -74.51 -47.82 30.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.305 -179.808 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.473 ' HG2' ' HA ' ' A' ' 53' ' ' LYS . 3.5 pt-20 -56.21 -31.79 63.8 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.933 HD12 ' HA ' ' A' ' 54' ' ' ASN . 15.6 mt -71.04 -43.26 76.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.897 178.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.825 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.5 m -58.48 -46.96 85.57 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.255 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.757 HG23 HG12 ' A' ' 24' ' ' VAL . 55.5 mt -60.08 -55.56 23.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.458 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.2 -34.12 68.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.245 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -56.8 -49.17 76.14 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.197 0.522 . . . . 0.0 109.899 179.146 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.825 HD12 ' O ' ' A' ' 58' ' ' SER . 1.2 mp -55.09 -48.77 73.1 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.867 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.409 ' CE ' ' HB ' ' A' ' 24' ' ' VAL . 12.5 mmt -44.85 -59.84 2.34 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.764 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.94 -23.58 61.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.589 179.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.405 ' O ' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -82.03 -29.0 32.19 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.293 0.568 . . . . 0.0 110.538 179.37 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.778 HG21 ' HG ' ' A' ' 21' ' ' LEU . 2.3 mm -73.41 -45.7 51.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.913 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.3 -32.43 17.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.013 -178.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.806 ' O ' HG23 ' A' ' 69' ' ' THR . 0.3 OUTLIER -98.08 22.18 9.78 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.233 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.806 HG23 ' O ' ' A' ' 68' ' ' SER . 0.6 OUTLIER 179.36 149.75 0.29 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.817 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -78.9 61.2 3.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.951 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.07 120.59 10.57 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.806 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.2 m -65.32 132.71 49.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.774 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.34 -31.51 54.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.83 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -61.33 -45.75 93.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.437 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.42 -33.72 75.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.424 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.625 ' CD1' HD23 ' A' ' 62' ' ' LEU . 20.9 mm -68.53 -33.88 62.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.787 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -67.8 -48.69 65.58 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.856 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -49.02 70.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.578 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -56.61 -33.54 66.35 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 178.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.824 ' O ' HG23 ' A' ' 84' ' ' VAL . 54.8 t80 -64.89 -35.62 81.73 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 177.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -69.54 -37.05 76.92 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.93 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.5 -35.38 75.8 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 121.28 0.562 . . . . 0.0 109.633 178.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.702 HD13 ' CD2' ' A' ' 27' ' ' LEU . 7.1 mt -75.51 -31.57 60.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.082 178.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.824 HG23 ' O ' ' A' ' 80' ' ' TYR . 75.6 t -67.71 -34.64 69.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.386 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? -72.15 -49.42 36.01 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.277 179.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 69.6 m -63.4 -41.67 98.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.18 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.1 t -62.94 -50.0 72.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.321 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -50.59 -42.37 55.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.564 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -70.64 -29.17 65.46 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.636 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.566 HD11 HG12 ' A' ' 52' ' ' ILE . 7.0 tt -67.86 -49.23 63.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.948 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.45 ' CD2' ' CE1' ' A' ' 34' ' ' PHE . 6.8 mt -61.78 -46.64 88.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.128 0.49 . . . . 0.0 109.797 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 12.1 p -54.94 -42.52 72.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.452 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.84 -47.33 81.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.348 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.495 ' CD2' HG22 ' A' ' 38' ' ' VAL . 4.2 mt -59.03 -45.15 91.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.439 179.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.4 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 2.5 mp0 -55.83 -39.39 71.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.333 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.12 -30.84 70.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.818 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 43.6 mttt -68.5 -54.0 19.61 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.958 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 0.0 OUTLIER -65.54 -37.18 85.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.876 0.37 . . . . 0.0 110.786 179.859 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -59.43 -42.35 91.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.658 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -78.0 -48.98 14.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.711 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -67.1 -172.59 0.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.777 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -70.7 132.28 45.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.903 0.383 . . . . 0.0 110.784 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.139 179.768 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 40.6 mm-40 . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.786 0.327 . . . . 0.0 111.038 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 169.01 62.67 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.552 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -82.94 53.68 4.49 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.744 2.296 . . . . 0.0 112.44 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -175.31 -46.04 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.515 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.441 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.1 p -57.45 -29.46 64.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.884 0.373 . . . . 0.0 110.945 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.489 ' HG ' HG21 ' A' ' 66' ' ' ILE . 30.0 mt -60.14 -32.86 71.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.86 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 40.4 t -59.83 -52.33 62.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.096 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -53.76 -46.41 70.92 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.009 0.433 . . . . 0.0 110.657 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.487 ' CG1' ' HE3' ' A' ' 63' ' ' MET . 10.7 t -59.45 -43.24 90.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.436 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.93 -36.26 91.84 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.604 -0.808 . . . . 0.0 111.763 179.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -49.06 76.98 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.98 0.419 . . . . 0.0 110.218 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.97 HD13 HD13 ' A' ' 83' ' ' LEU . 6.6 mt -62.16 -38.8 90.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.945 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.522 ' HG2' HG21 ' A' ' 59' ' ' ILE . 0.4 OUTLIER -53.68 -37.79 63.56 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.757 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.42 -40.53 81.17 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.793 178.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -62.54 -36.91 84.11 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.046 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.443 HD11 ' HB2' ' A' ' 55' ' ' LEU . 3.3 mm? -62.61 -48.42 79.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.256 179.418 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -59.99 -35.07 74.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.361 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -60.59 -46.08 91.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.341 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.825 ' O ' HG23 ' A' ' 38' ' ' VAL . 18.9 m-85 -62.59 -41.16 98.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.415 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -57.84 -38.22 75.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.885 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.11 -54.39 30.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.554 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 29.1 t -58.33 -38.24 68.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.779 179.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.825 HG23 ' O ' ' A' ' 34' ' ' PHE . 45.2 t -74.99 -35.83 36.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.882 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.1 m -59.91 -34.88 73.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.633 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.55 -16.44 60.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.301 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.809 HD21 ' HE2' ' A' ' 98' ' ' LYS . 82.6 mt -75.51 -45.97 35.07 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.127 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 1.4 mptt 68.31 8.43 6.6 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.53 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -127.38 150.15 49.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.716 0.293 . . . . 0.0 110.684 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.63 ' O ' HG12 ' A' ' 48' ' ' VAL . . . 57.16 34.03 65.98 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.267 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.513 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 3.8 mmtp -63.01 -44.3 84.49 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.423 0.154 . . . . 0.0 111.389 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.513 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 32.2 Cg_exo -58.78 -49.18 12.22 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.495 2.13 . . . . 0.0 112.864 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -64.59 -50.09 68.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.734 0.302 . . . . 0.0 111.704 -179.299 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.77 HG11 HG11 ' A' ' 38' ' ' VAL . 14.7 p -66.88 -46.75 84.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.186 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.482 ' N ' HG13 ' A' ' 48' ' ' VAL . 95.7 m-20 -60.24 -28.98 68.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.833 0.349 . . . . 0.0 110.759 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 20.9 ttt-85 -74.16 -47.11 38.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.42 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.402 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 14.4 pt20 -72.37 -46.15 56.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.607 0.717 . . . . 0.0 109.268 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.612 HG13 HG22 ' A' ' 48' ' ' VAL . 1.2 mt -57.48 -39.45 68.97 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-N 114.646 -1.161 . . . . 0.0 110.459 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.452 ' O ' HG12 ' A' ' 57' ' ' ILE . 1.2 tmtt? -64.34 -47.78 78.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.592 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.494 ' HA ' HG12 ' A' ' 57' ' ' ILE . 14.2 m-20 -51.5 -49.18 62.37 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.707 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.443 ' HB2' HD11 ' A' ' 31' ' ' LEU . 14.2 mt -58.98 -40.73 85.7 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.493 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -56.99 -29.68 63.48 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.164 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.494 HG12 ' HA ' ' A' ' 54' ' ' ASN . 5.3 mm -71.19 -43.52 74.81 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.236 178.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.861 ' O ' HD12 ' A' ' 62' ' ' LEU . 28.3 t -57.94 -52.98 63.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.666 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.522 HG21 ' HG2' ' A' ' 28' ' ' LYS . 3.4 mt -58.38 -52.79 54.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.943 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.53 -36.47 71.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.492 179.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.99 -49.31 76.15 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.37 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.861 HD12 ' O ' ' A' ' 58' ' ' SER . 1.7 mp -55.21 -52.51 63.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.537 179.327 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.487 ' HE3' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.03 -55.93 5.12 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.131 179.853 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.53 -24.28 66.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.65 179.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.3 mtpt -82.06 -29.06 32.06 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-O 121.135 0.493 . . . . 0.0 110.488 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.659 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.1 mm -71.64 -39.5 69.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.225 -179.399 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -93.11 -28.28 16.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.695 -179.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.773 ' O ' HG23 ' A' ' 69' ' ' THR . 0.3 OUTLIER -103.73 24.25 11.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.759 0.314 . . . . 0.0 111.753 -179.553 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.773 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 176.92 150.09 0.15 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.057 179.488 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 1.9 mpp? -76.01 69.69 2.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.991 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.57 125.65 27.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.774 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.65 142.89 33.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.794 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.66 -35.12 60.68 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.938 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -59.28 -47.3 85.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.682 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -59.92 -32.48 70.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.465 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.602 ' CD1' HD23 ' A' ' 62' ' ' LEU . 26.9 mm -72.0 -34.27 50.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.702 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.22 -46.04 85.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.684 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -49.24 66.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.549 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.539 ' O ' HD12 ' A' ' 83' ' ' LEU . 2.4 mt-10 -56.5 -34.35 66.89 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.811 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.899 ' O ' HG23 ' A' ' 84' ' ' VAL . 16.9 t80 -64.73 -35.34 80.73 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 177.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -69.26 -37.52 77.98 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.954 178.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.19 -36.9 78.66 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 178.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.97 HD13 HD13 ' A' ' 27' ' ' LEU . 1.2 mt -75.48 -30.48 59.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.948 178.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.899 HG23 ' O ' ' A' ' 80' ' ' TYR . 93.2 t -67.88 -35.0 70.65 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.288 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.02 -49.38 37.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.206 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.9 -34.7 79.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.129 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.414 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 3.2 m -65.25 -46.35 80.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.286 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -56.36 -44.93 80.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.593 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -65.56 -30.68 71.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.689 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.569 HD23 ' C ' ' A' ' 90' ' ' LEU . 6.3 tt -64.26 -49.2 72.8 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.875 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.446 HD23 ' CD2' ' A' ' 90' ' ' LEU . 5.7 mt -60.67 -44.27 96.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.206 0.527 . . . . 0.0 110.018 179.664 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.52 -40.22 71.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.95 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.22 -53.7 34.01 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.083 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.418 HD13 HG22 ' A' ' 38' ' ' VAL . 67.2 mt -60.07 -38.17 82.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.736 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -54.2 48.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.909 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -56.42 -38.89 72.19 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.029 0.442 . . . . 0.0 110.314 179.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -51.78 62.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.886 179.51 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.809 ' HE2' HD21 ' A' ' 41' ' ' LEU . 3.2 mttm -60.69 -53.52 56.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.783 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -58.34 -25.36 61.86 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.682 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -69.1 -53.21 21.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.853 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 53.58 -176.38 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.078 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.86 -45.91 0.87 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.757 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.824 179.795 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.829 0.347 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 146.7 168.33 13.57 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.521 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.43 -176.1 1.55 Allowed 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.627 2.218 . . . . 0.0 112.361 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 164.48 -71.15 0.19 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.512 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.675 ' HB3' HG21 ' A' ' 76' ' ' ILE . 0.5 OUTLIER -94.58 -20.02 19.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.67 0.271 . . . . 0.0 111.098 179.985 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.7 mt -54.05 -32.83 55.74 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.098 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.524 HG13 ' N ' ' A' ' 23' ' ' LYS . 9.1 p -65.79 -47.84 84.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.251 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.524 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -59.42 -53.35 59.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.167 0.508 . . . . 0.0 110.519 179.726 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 1.052 HG12 HG23 ' A' ' 59' ' ' ILE . 3.8 t -56.79 -39.04 61.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.058 179.132 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -63.75 -37.29 94.47 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.596 -0.811 . . . . 0.0 111.158 178.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.5 m -57.09 -44.85 83.57 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 178.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.647 HD13 HD13 ' A' ' 83' ' ' LEU . 0.5 OUTLIER -61.75 -37.75 85.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.701 178.762 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.74 -40.33 69.2 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.556 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.82 -37.84 88.96 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.25 178.428 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.58 -34.31 77.54 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.861 179.066 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.818 HD22 HG23 ' A' ' 52' ' ' ILE . 9.4 mt -62.59 -50.26 71.98 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.958 179.275 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -57.81 -38.24 75.2 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.218 179.164 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.4 tptt -57.68 -44.56 85.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.295 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.818 ' O ' HG23 ' A' ' 38' ' ' VAL . 4.7 m-85 -61.22 -39.86 91.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.083 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -56.36 -43.72 79.42 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.355 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -59.9 -54.47 45.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.505 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.8 t -56.42 -37.88 53.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.687 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.974 HG21 HG11 ' A' ' 48' ' ' VAL . 60.5 t -71.79 -37.68 63.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.816 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 t -58.01 -37.25 73.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.36 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.47 -20.45 60.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.035 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.513 HD11 ' HB3' ' A' ' 94' ' ' LEU . 43.2 mt -81.73 -28.42 33.38 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.953 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.5 -75.18 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.999 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -57.82 157.04 7.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.998 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.436 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 58.57 54.78 34.96 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.512 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.44 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -87.19 -49.68 0.46 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.578 0.228 . . . . 0.0 111.324 -179.737 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 52.5 Cg_exo -53.38 -41.88 69.64 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.556 2.17 . . . . 0.0 112.647 -179.481 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -56.62 -50.36 72.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.967 0.413 . . . . 0.0 110.888 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.974 HG11 HG21 ' A' ' 38' ' ' VAL . 2.1 t -64.34 -56.13 17.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.613 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 49.0 m-80 -54.82 -25.44 28.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.07 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.16 -48.65 41.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.851 0.357 . . . . 0.0 111.5 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -77.19 -45.3 27.11 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-O 121.409 0.623 . . . . 0.0 109.815 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.826 ' CD1' HG12 ' A' ' 48' ' ' VAL . 4.0 mt -57.77 -35.73 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.592 179.039 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.487 ' O ' HG12 ' A' ' 57' ' ' ILE . 2.9 tmtm? -69.88 -54.25 14.32 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.329 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.526 ' HA ' HG12 ' A' ' 57' ' ' ILE . 27.2 p30 -60.74 -30.77 70.2 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.524 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.602 HD22 HD23 ' A' ' 83' ' ' LEU . 75.2 mt -72.02 -38.94 69.49 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.23 -31.13 68.77 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.526 HG12 ' HA ' ' A' ' 54' ' ' ASN . 4.8 mm -68.09 -43.64 85.1 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.294 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.691 178.505 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.767 ' O ' HD12 ' A' ' 62' ' ' LEU . 5.1 t -58.56 -51.34 70.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.341 179.417 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 1.052 HG23 HG12 ' A' ' 24' ' ' VAL . 57.3 mt -61.69 -53.4 48.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.658 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.435 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 0.4 OUTLIER -55.17 -32.7 62.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.293 179.434 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.14 -49.23 75.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.761 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.767 HD12 ' O ' ' A' ' 58' ' ' SER . 0.9 OUTLIER -56.4 -57.3 12.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.069 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.53 ' SD ' HG22 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -46.0 -53.38 10.17 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.241 0.338 . . . . 0.0 110.967 -179.882 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.92 -24.48 66.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.923 0.392 . . . . 0.0 110.863 179.469 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.0 mtpt -82.61 -29.21 30.3 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.196 0.522 . . . . 0.0 110.652 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.643 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.6 mm -73.02 -35.59 48.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.132 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.62 -26.34 15.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.578 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.805 ' O ' HG23 ' A' ' 69' ' ' THR . 1.1 m -106.44 22.11 16.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.703 0.287 . . . . 0.0 111.705 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.805 HG23 ' O ' ' A' ' 68' ' ' SER . 0.6 OUTLIER 177.74 155.86 0.35 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.836 179.568 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 9.2 mtp -82.59 72.48 9.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.818 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.4 mmm -68.71 134.13 49.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.96 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.59 138.84 33.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.731 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.18 -31.57 53.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.911 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.82 -43.34 98.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.641 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -68.08 -31.5 71.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.685 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.675 HG21 ' HB3' ' A' ' 20' ' ' SER . 29.7 mm -71.82 -38.08 64.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.869 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -52.07 56.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.899 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.74 -48.85 79.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.721 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -56.35 -32.6 64.86 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 178.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.908 ' O ' HG23 ' A' ' 84' ' ' VAL . 1.9 t80 -64.65 -35.9 82.53 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 177.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -69.57 -37.66 77.06 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.057 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.05 -36.08 76.52 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 121.186 0.517 . . . . 0.0 109.678 178.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.647 HD13 HD13 ' A' ' 27' ' ' LEU . 3.0 mt -76.2 -30.54 58.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.004 178.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.908 HG23 ' O ' ' A' ' 80' ' ' TYR . 60.9 t -68.97 -35.84 71.09 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.457 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.01 -49.24 38.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.086 0.469 . . . . 0.0 110.322 179.52 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.1 p -65.01 -41.6 95.19 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.212 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.5 m -64.54 -50.17 68.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.587 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -51.97 -41.99 62.56 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.676 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.96 -30.64 68.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.723 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 tt -64.91 -48.98 72.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.431 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.9 mt -62.06 -49.57 75.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.068 0.461 . . . . 0.0 109.977 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.4 m -56.49 -30.7 63.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.72 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.49 ' HA ' ' HG2' ' A' ' 96' ' ' LYS . . . -69.88 -53.28 18.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.159 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.513 ' HB3' HD11 ' A' ' 41' ' ' LEU . 2.8 mt -61.87 -45.61 93.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.044 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.404 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 72.3 mt-30 -62.11 -44.93 95.58 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.207 -179.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.49 ' HG2' ' HA ' ' A' ' 93' ' ' ALA . 1.3 pttm -61.68 -29.49 70.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.936 0.398 . . . . 0.0 110.184 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.9 mtmm -69.1 -58.19 4.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.109 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.434 ' HD2' HD21 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -59.32 -50.94 72.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.534 -179.401 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -57.16 -39.96 76.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.158 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -59.76 -44.83 93.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.814 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 58.1 -177.45 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.925 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -132.17 7.77 4.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.503 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 C--N 1.331 -0.218 0 CA-C-O 120.711 0.291 . . . . 0.0 110.817 -179.977 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.834 0.349 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 147.3 -133.92 4.96 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.491 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -66.24 66.19 0.47 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.695 2.263 . . . . 0.0 112.282 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.16 -45.02 0.89 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.377 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.11 -27.85 14.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.744 0.307 . . . . 0.0 110.78 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.562 ' HG ' HG21 ' A' ' 66' ' ' ILE . 10.4 mt -55.88 -32.94 64.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.046 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.495 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.6 p -63.84 -45.75 96.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.013 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.495 ' N ' HG13 ' A' ' 22' ' ' VAL . 21.1 mttt -60.3 -49.27 78.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.094 0.473 . . . . 0.0 110.48 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.458 ' CG1' HG23 ' A' ' 59' ' ' ILE . 21.6 t -56.96 -43.48 80.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.403 179.491 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.02 -38.05 95.44 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.645 -0.788 . . . . 0.0 111.452 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.2 m -56.76 -45.63 81.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.084 0.468 . . . . 0.0 109.938 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.85 ' CD2' HD13 ' A' ' 83' ' ' LEU . 8.6 tp -61.91 -38.37 88.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.895 179.119 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -41.22 67.94 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 178.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -65.06 -37.93 89.18 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.471 178.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.02 -33.39 75.94 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.929 178.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.782 HD12 HD12 ' A' ' 59' ' ' ILE . 5.1 mt -62.17 -51.91 65.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.166 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -57.91 -36.78 72.93 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.211 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.456 ' O ' HG23 ' A' ' 37' ' ' VAL . 22.1 tptt -58.61 -43.97 89.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.469 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.826 ' O ' HG23 ' A' ' 38' ' ' VAL . 16.2 m-85 -62.72 -42.56 99.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.424 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -54.13 -45.64 71.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.838 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -55.27 32.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.895 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 33' ' ' LYS . 31.5 t -55.94 -38.69 53.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.914 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.858 HG11 HG11 ' A' ' 48' ' ' VAL . 46.6 t -75.19 -33.81 29.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.75 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.0 t -61.2 -33.29 73.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.512 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.2 -29.95 67.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.779 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.722 HD22 ' HE2' ' A' ' 98' ' ' LYS . 0.9 OUTLIER -116.55 79.92 1.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.797 179.842 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.45 -27.9 2.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.396 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -56.38 107.39 0.37 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.967 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.586 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 80.89 54.59 3.58 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.321 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.491 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -82.61 -45.97 0.92 Allowed Pre-proline 0 C--N 1.329 -0.301 0 N-CA-C 111.44 0.163 . . . . 0.0 111.44 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 52.7 Cg_exo -53.19 -43.75 54.61 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.296 1.998 . . . . 0.0 112.424 -179.546 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -58.37 -49.53 76.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.941 0.401 . . . . 0.0 110.622 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.858 HG11 HG11 ' A' ' 38' ' ' VAL . 4.9 t -60.86 -54.93 28.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.74 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.429 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 6.5 m120 -54.02 -25.73 22.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.032 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.83 -51.74 20.96 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.955 0.407 . . . . 0.0 111.52 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -73.26 -45.41 55.95 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.469 0.652 . . . . 0.0 109.276 179.548 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.652 HG13 HG12 ' A' ' 48' ' ' VAL . 1.4 mt -57.51 -31.95 40.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.312 178.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 25.6 tttt -69.32 -52.41 27.59 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.475 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.914 ' HA ' HD12 ' A' ' 57' ' ' ILE . 5.5 m120 -51.14 -41.68 60.25 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.834 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.8 mp -68.86 -42.98 76.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.256 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.402 ' HA ' ' CD1' ' A' ' 31' ' ' LEU . 0.5 OUTLIER -56.75 -36.6 69.95 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 178.579 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.914 HD12 ' HA ' ' A' ' 54' ' ' ASN . 11.8 mt -71.31 -42.43 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.329 178.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.855 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.1 m -59.73 -54.97 40.12 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.722 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.782 HD12 HD12 ' A' ' 31' ' ' LEU . 45.6 mt -58.5 -53.94 39.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.879 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.9 -34.39 67.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.578 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.58 -49.62 76.8 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.244 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.855 HD12 ' O ' ' A' ' 58' ' ' SER . 2.1 mp -55.53 -54.73 40.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.463 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.45 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -44.86 -57.0 4.04 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.19 -179.839 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.06 -24.8 64.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.832 0.348 . . . . 0.0 110.599 179.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.488 ' HA ' HG23 ' A' ' 69' ' ' THR . 15.7 mtpt -81.96 -29.76 32.02 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.624 179.437 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -71.88 -33.76 49.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.076 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 21.2 mmmt -93.82 -2.51 53.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.273 -179.112 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.515 ' O ' HG22 ' A' ' 69' ' ' THR . 13.0 m -140.17 19.87 2.43 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.515 HG22 ' O ' ' A' ' 68' ' ' SER . 0.4 OUTLIER -161.64 161.72 29.68 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.495 179.281 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -95.23 45.65 1.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.028 0.442 . . . . 0.0 110.58 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.84 130.43 29.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.215 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.6 m -80.08 142.38 34.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.747 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -30.52 59.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.74 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -47.25 86.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.434 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -64.31 -32.82 74.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.434 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.653 ' CD1' HD23 ' A' ' 62' ' ' LEU . 25.4 mm -70.59 -36.81 67.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.742 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -63.32 -52.21 62.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.77 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.8 tptt -62.18 -46.62 88.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.561 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -56.45 -33.31 65.77 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.902 ' O ' HG23 ' A' ' 84' ' ' VAL . 2.1 t80 -64.35 -37.5 87.74 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 177.727 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.86 -36.54 75.6 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.977 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.45 -36.07 75.24 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.247 0.546 . . . . 0.0 109.794 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.85 HD13 ' CD2' ' A' ' 27' ' ' LEU . 2.7 mt -76.74 -31.18 56.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.032 179.019 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.902 HG23 ' O ' ' A' ' 80' ' ' TYR . 47.7 t -69.83 -35.14 63.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.617 179.443 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -72.21 -49.46 35.22 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.447 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.4 m -66.03 -40.33 90.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.435 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.417 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 28.4 t -64.89 -50.06 68.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.607 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -52.84 -44.43 66.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.842 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -69.41 -27.68 65.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.82 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.594 HD11 HG12 ' A' ' 52' ' ' ILE . 7.3 tt -67.73 -49.22 63.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.067 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.9 mt -62.3 -49.11 76.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.175 0.512 . . . . 0.0 109.863 179.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.3 m -55.42 -37.65 67.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.46 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.4 -40.28 74.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.827 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.575 ' CD2' HG22 ' A' ' 38' ' ' VAL . 10.6 tp -62.64 -51.8 65.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -55.91 -50.53 70.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.618 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -58.81 -28.98 66.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.128 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.8 tttm -62.77 -52.17 64.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.611 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.722 ' HE2' HD22 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -60.19 -53.37 58.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.774 -179.985 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -25.53 63.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.705 179.531 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -70.16 -49.09 54.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.814 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 55.9 -179.39 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.904 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -60.48 -72.87 0.1 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.827 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.827 -179.992 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.892 0.377 . . . . 0.0 110.999 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 135.92 69.18 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.583 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -74.79 -32.07 6.04 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.56 2.173 . . . . 0.0 112.273 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.54 71.2 0.36 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.54 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.669 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.9 p -178.1 -40.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.795 0.331 . . . . 0.0 110.838 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.517 ' HG ' HG21 ' A' ' 66' ' ' ILE . 3.4 mp -64.38 -32.64 74.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.029 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 32.4 t -62.5 -52.78 55.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.291 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.2 tptt -54.17 -45.22 72.04 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.919 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.779 HG12 HG23 ' A' ' 59' ' ' ILE . 11.5 t -56.73 -49.15 79.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.296 179.551 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.9 -40.07 98.37 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.554 -0.831 . . . . 0.0 111.559 178.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.808 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.1 OUTLIER -56.71 -42.32 78.97 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.253 0.549 . . . . 0.0 109.716 179.269 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.65 HD13 HD13 ' A' ' 83' ' ' LEU . 0.8 OUTLIER -59.91 -39.63 86.09 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.181 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -53.88 -35.02 61.14 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.808 ' HG3' ' HA ' ' A' ' 26' ' ' THR . 2.6 mmtt -60.17 -48.26 82.48 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.366 -0.833 . . . . 0.0 109.14 177.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.94 -33.86 62.66 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.402 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.542 HD13 HD11 ' A' ' 59' ' ' ILE . 1.4 mp -63.47 -49.74 72.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.244 179.324 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.67 -32.91 70.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.324 179.332 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 tppt? -61.91 -45.93 91.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.284 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.792 ' O ' HG23 ' A' ' 38' ' ' VAL . 8.5 m-85 -60.09 -50.17 74.77 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.659 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -54.22 -38.6 65.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.918 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -51.71 68.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.014 0.435 . . . . 0.0 110.599 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.451 HG12 HD23 ' A' ' 41' ' ' LEU . 30.7 t -62.67 -37.85 80.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.736 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 1.034 HG22 HD21 ' A' ' 94' ' ' LEU . 59.9 t -63.07 -36.22 74.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.954 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.5 m -75.83 -29.22 58.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.926 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.22 -29.21 38.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.376 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.565 HD22 ' HE3' ' A' ' 98' ' ' LYS . 3.6 pp -93.4 -35.94 12.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.999 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.49 ' N ' HD12 ' A' ' 41' ' ' LEU . 1.3 mptt 58.41 102.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.97 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 174.9 122.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.729 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.633 ' O ' HG12 ' A' ' 48' ' ' VAL . . . 58.14 68.09 1.87 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.477 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.468 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -69.5 -47.59 25.87 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 111.553 0.205 . . . . 0.0 111.553 -179.705 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.468 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 35.8 Cg_exo -60.52 -49.38 9.04 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.504 2.136 . . . . 0.0 113.07 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 2.0 pm0 -58.21 -50.03 74.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.845 0.355 . . . . 0.0 111.649 -179.135 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.755 HG11 HG11 ' A' ' 38' ' ' VAL . 14.6 p -72.66 -46.55 53.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.343 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.483 ' N ' HG13 ' A' ' 48' ' ' VAL . 98.9 m-20 -59.43 -39.0 82.14 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.992 -0.283 . . . . 0.0 111.528 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.423 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 27.8 ptt180 -71.48 -41.85 68.83 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -179.422 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.404 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 28.9 mt-30 -71.78 -46.87 56.94 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 179.187 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.641 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.1 mt -57.33 -30.0 34.43 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.059 178.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.499 ' HD3' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -69.07 -51.15 41.72 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.342 179.035 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.911 ' HA ' HD12 ' A' ' 57' ' ' ILE . 5.0 m120 -51.5 -41.44 60.99 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.601 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 26.3 mt -67.41 -43.83 80.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.219 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.486 ' N ' HD21 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -56.74 -37.56 71.17 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.515 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.911 HD12 ' HA ' ' A' ' 54' ' ' ASN . 9.7 mt -71.26 -40.76 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.134 178.557 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.841 ' O ' HD12 ' A' ' 62' ' ' LEU . 39.9 t -57.83 -53.01 63.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.477 179.538 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.779 HG23 HG12 ' A' ' 24' ' ' VAL . 4.4 mt -60.39 -52.98 55.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.568 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.77 -33.67 68.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.465 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.84 -49.36 78.01 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.271 179.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.841 HD12 ' O ' ' A' ' 58' ' ' SER . 1.2 mp -55.42 -55.1 35.6 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.703 179.448 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.426 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -44.93 -58.54 3.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.164 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.49 -23.8 63.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.683 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.512 ' HA ' HG23 ' A' ' 69' ' ' THR . 1.0 OUTLIER -82.48 -29.79 30.34 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.545 179.511 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.662 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.9 mm -71.63 -35.78 57.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.236 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.7 mmmt -96.07 1.41 52.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.347 -179.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.488 ' O ' HG22 ' A' ' 69' ' ' THR . 19.5 m -141.93 23.33 2.07 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.512 HG23 ' HA ' ' A' ' 65' ' ' LYS . 0.7 OUTLIER -160.39 174.03 14.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.924 0.392 . . . . 0.0 110.756 179.239 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.17 38.2 2.27 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.643 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.0 mmm -55.52 141.3 37.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.059 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.3 m -84.9 145.25 27.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.754 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.4 -31.46 61.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.755 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.11 -37.9 84.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.394 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -68.59 -32.57 72.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.515 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.6 ' CD1' HD23 ' A' ' 62' ' ' LEU . 25.6 mm -72.51 -34.48 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.717 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.02 -50.72 61.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.66 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.9 -46.3 88.47 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.5 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -56.45 -34.22 66.64 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.913 ' O ' HG23 ' A' ' 84' ' ' VAL . 3.3 t80 -64.15 -37.06 86.11 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 177.609 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.43 -36.89 77.1 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.938 178.635 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.59 -36.33 76.06 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.126 0.488 . . . . 0.0 109.687 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.65 HD13 HD13 ' A' ' 27' ' ' LEU . 4.7 mt -76.43 -32.42 58.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.917 178.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.913 HG23 ' O ' ' A' ' 80' ' ' TYR . 58.9 t -67.95 -34.3 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.428 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -48.81 39.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.357 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.14 -38.51 91.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.574 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.444 ' HB2' ' CZ ' ' A' ' 34' ' ' PHE . 25.6 p -66.13 -46.49 77.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.596 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.81 -44.21 73.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.972 0.415 . . . . 0.0 110.559 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -67.93 -30.57 69.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.681 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.598 HD11 HD11 ' A' ' 52' ' ' ILE . 7.6 tt -62.77 -47.75 82.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.739 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.666 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.8 mt -62.41 -49.19 76.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.124 0.488 . . . . 0.0 109.708 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 24.1 m -57.1 -40.34 76.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.473 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.73 -51.71 46.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.712 179.568 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 1.034 HD21 HG22 ' A' ' 38' ' ' VAL . 1.2 mp -53.48 -51.6 62.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.794 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -55.67 -40.27 72.06 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.089 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.05 -53.28 60.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.61 179.351 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.4 mttt -54.67 -36.54 64.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.196 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.565 ' HE3' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -63.98 -53.93 42.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.987 0.422 . . . . 0.0 110.656 179.925 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -62.71 -25.3 68.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.572 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -77.38 -52.84 8.48 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.134 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -127.62 150.91 49.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.007 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -97.38 -38.5 9.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.923 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.035 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.88 0.371 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -159.81 -95.43 0.11 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.479 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.546 ' HA ' HD12 ' A' ' 21' ' ' LEU . 52.1 Cg_exo -52.88 158.48 6.35 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.548 2.165 . . . . 0.0 112.321 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.95 -41.64 2.13 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.502 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.694 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.4 m -100.53 -30.51 11.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.857 0.361 . . . . 0.0 110.911 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.546 HD12 ' HA ' ' A' ' 18' ' ' PRO . 1.1 mt -66.13 -32.89 74.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.014 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.529 HG13 ' N ' ' A' ' 23' ' ' LYS . 9.1 p -60.63 -49.42 84.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.358 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.529 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -64.32 -46.4 83.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.852 0.358 . . . . 0.0 110.648 179.8 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.694 HG23 ' O ' ' A' ' 20' ' ' SER . 44.4 t -56.84 -40.68 72.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.203 179.274 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.14 -41.98 96.72 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.646 -0.787 . . . . 0.0 111.424 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.606 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -57.97 -33.26 68.68 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.133 0.492 . . . . 0.0 109.998 179.2 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.887 ' CD2' HD13 ' A' ' 83' ' ' LEU . 13.6 tp -67.98 -45.49 73.98 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.0 mttm -52.8 -33.67 50.04 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.606 ' HG3' ' HA ' ' A' ' 26' ' ' THR . 15.7 mttt -63.52 -47.27 82.35 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.831 178.321 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.453 ' HG2' ' CZ ' ' A' ' 34' ' ' PHE . 63.1 ttt180 -61.34 -32.28 72.16 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.409 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.446 HD23 ' HG2' ' A' ' 56' ' ' GLU . 4.2 mp -62.47 -50.6 70.81 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.268 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -58.03 -37.64 74.74 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.12 0.486 . . . . 0.0 109.915 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.423 ' O ' HG23 ' A' ' 37' ' ' VAL . 24.7 tptt -57.75 -42.83 84.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.061 179.205 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.854 ' O ' HG23 ' A' ' 38' ' ' VAL . 18.9 m-30 -62.5 -42.46 99.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.254 179.45 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -53.19 -46.14 68.88 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.649 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -59.98 -54.32 47.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.505 179.536 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 33' ' ' LYS . 35.8 t -56.05 -37.86 50.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.559 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.939 HG11 HG11 ' A' ' 48' ' ' VAL . 44.5 t -74.09 -33.53 35.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.583 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.3 t -61.76 -32.93 73.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.313 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.28 -27.44 56.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.212 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.789 HD21 ' HD2' ' A' ' 98' ' ' LYS . 18.7 mt -59.78 -45.76 91.29 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.929 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 63.61 14.7 8.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.487 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -133.55 134.14 42.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.849 0.357 . . . . 0.0 110.9 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.551 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 59.0 69.81 1.17 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.487 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.528 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 2.0 mmpm? -82.93 -42.99 0.88 Allowed Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.1 Cg_exo -53.6 -49.0 18.85 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.301 2.0 . . . . 0.0 112.374 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.436 ' HA ' ' HG2' ' A' ' 50' ' ' ARG . 0.9 OUTLIER -55.6 -46.93 77.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.011 0.434 . . . . 0.0 111.076 179.969 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.939 HG11 HG11 ' A' ' 38' ' ' VAL . 11.8 t -65.83 -55.69 18.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.136 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -53.43 -34.9 59.59 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -179.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.448 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 5.3 ptp85 -74.37 -35.23 63.53 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -179.365 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.448 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 26.2 mt-30 -80.71 -47.56 13.81 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.554 0.692 . . . . 0.0 109.531 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.624 HG13 ' O ' ' A' ' 48' ' ' VAL . 2.6 mt -60.23 -33.67 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.101 178.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.03 -54.13 14.53 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.265 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.96 ' HA ' HD12 ' A' ' 57' ' ' ILE . 26.8 p30 -59.01 -25.48 63.69 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.738 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.547 HD22 HD23 ' A' ' 83' ' ' LEU . 84.6 mt -79.27 -44.44 21.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.356 . . . . 0.0 110.102 178.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.446 ' HG2' HD23 ' A' ' 31' ' ' LEU . 1.8 tm-20 -56.71 -35.67 68.8 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.96 HD12 ' HA ' ' A' ' 54' ' ' ASN . 12.0 mt -70.54 -41.88 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.127 178.691 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.69 ' O ' HD12 ' A' ' 62' ' ' LEU . 24.2 m -58.69 -55.14 38.91 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.472 179.569 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.562 HG12 HD23 ' A' ' 27' ' ' LEU . 4.0 mt -60.61 -52.51 60.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.63 179.519 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -58.48 -34.1 70.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.505 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.33 -49.63 76.51 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.024 0.44 . . . . 0.0 110.023 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.69 HD12 ' O ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -55.61 -52.81 62.52 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.277 178.967 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.497 ' HE2' HG11 ' A' ' 24' ' ' VAL . 17.7 tpp -45.02 -57.92 3.52 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.211 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.9 -24.2 64.1 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.619 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.469 ' HA ' HG23 ' A' ' 69' ' ' THR . 2.8 mtmp? -81.97 -29.78 31.98 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.539 179.357 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.655 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.8 mm -71.63 -36.38 59.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.095 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt -96.18 1.23 52.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.945 -0.571 . . . . 0.0 112.265 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.49 ' O ' HG22 ' A' ' 69' ' ' THR . 3.0 t -138.46 20.49 2.74 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.49 HG22 ' O ' ' A' ' 68' ' ' SER . 0.7 OUTLIER -160.84 177.08 10.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.888 0.375 . . . . 0.0 110.649 179.405 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.3 ttt -109.21 41.39 1.64 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.536 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 15.3 mmm -55.49 145.02 23.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.138 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.48 146.65 23.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.797 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 86.4 mtm-85 -54.75 -31.37 58.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.797 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.8 -39.0 87.26 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.414 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -67.47 -34.3 76.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.433 179.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.571 HD13 HD23 ' A' ' 62' ' ' LEU . 26.1 mm -72.09 -34.0 48.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.721 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -66.68 -46.34 75.95 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.801 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 4.8 mmmt -66.54 -47.54 72.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.694 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.66 -34.18 67.09 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.809 ' O ' HG23 ' A' ' 84' ' ' VAL . 88.3 t80 -64.96 -36.67 85.13 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.77 -37.79 76.52 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.936 178.493 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.98 -32.26 71.82 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.111 0.481 . . . . 0.0 109.758 178.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.887 HD13 ' CD2' ' A' ' 27' ' ' LEU . 5.0 mt -78.31 -30.62 48.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.021 178.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.809 HG23 ' O ' ' A' ' 80' ' ' TYR . 60.2 t -68.97 -37.05 76.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.368 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -49.15 35.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.452 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.7 p -64.47 -45.28 88.05 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.727 179.662 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 89.4 p -60.21 -49.28 78.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.56 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -54.5 -39.52 67.64 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.764 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -68.12 -31.63 71.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.753 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.447 HD23 HD23 ' A' ' 91' ' ' LEU . 6.8 tt -66.05 -46.46 77.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.997 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.447 HD23 HD23 ' A' ' 90' ' ' LEU . 6.5 mt -65.14 -48.52 73.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.169 0.509 . . . . 0.0 109.809 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.3 m -57.07 -32.68 66.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.539 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.416 ' O ' ' CG ' ' A' ' 96' ' ' LYS . . . -70.07 -53.11 18.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.777 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.657 ' HB3' HD11 ' A' ' 41' ' ' LEU . 14.4 mt -58.87 -42.2 88.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.672 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -49.71 75.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.036 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.425 ' HA ' ' HG2' ' A' ' 99' ' ' GLN . 27.3 pttt -61.61 -28.65 69.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.939 0.399 . . . . 0.0 110.46 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mttm -70.8 -50.47 35.26 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.692 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.789 ' HD2' HD21 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -70.75 -45.8 64.13 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 121.102 -0.239 . . . . 0.0 111.503 -179.203 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLN . . . . . 0.425 ' HG2' ' HA ' ' A' ' 96' ' ' LYS . 19.9 pt20 -59.63 -46.66 88.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.696 0.284 . . . . 0.0 111.263 -179.632 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -64.22 -39.83 94.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.828 0.347 . . . . 0.0 110.88 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.28 -30.08 70.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.805 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -86.31 -78.12 0.29 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.865 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.833 -179.918 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.724 0.297 . . . . 0.0 110.797 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -113.17 92.39 0.62 Allowed Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.573 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -54.88 90.3 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.54 2.16 . . . . 0.0 112.274 179.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -134.85 41.91 1.4 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.525 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.885 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.5 m -164.32 -43.76 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.766 0.317 . . . . 0.0 110.83 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.703 ' HG ' HG21 ' A' ' 66' ' ' ILE . 2.6 mt -57.06 -35.97 69.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.072 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.503 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.8 p -69.34 -46.69 76.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.191 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.503 ' N ' HG13 ' A' ' 22' ' ' VAL . 25.2 mttt -60.15 -46.52 89.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.168 0.509 . . . . 0.0 110.506 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.885 HG23 ' O ' ' A' ' 20' ' ' SER . 14.4 t -56.83 -45.97 83.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.632 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.76 -38.77 95.75 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.55 -0.833 . . . . 0.0 111.704 179.162 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -56.89 -43.85 81.74 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.057 0.456 . . . . 0.0 110.153 179.416 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.464 HD13 HD13 ' A' ' 83' ' ' LEU . 0.7 OUTLIER -61.63 -42.02 98.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.054 179.254 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.427 ' HA ' HD13 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -52.88 -40.07 63.19 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 178.786 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.53 -38.64 91.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.63 178.44 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.431 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -63.48 -36.56 84.16 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.922 179.12 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.732 HD22 HD12 ' A' ' 59' ' ' ILE . 5.9 mp -62.03 -43.52 98.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.254 179.334 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.28 -47.42 85.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.843 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.454 ' O ' HG23 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -60.06 -33.64 72.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.006 -179.991 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.848 ' O ' HG23 ' A' ' 38' ' ' VAL . 10.8 m-85 -65.59 -43.91 88.25 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.512 179.659 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -60.77 -39.3 88.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.476 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -59.15 -54.69 44.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.478 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 33' ' ' LYS . 24.0 t -58.8 -37.9 69.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.781 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.901 HG11 HG11 ' A' ' 48' ' ' VAL . 55.0 t -70.74 -31.45 45.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.061 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.3 m -73.82 -27.1 60.94 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.98 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.45 -34.86 65.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.413 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.79 HD12 ' O ' ' A' ' 42' ' ' LYS . 4.1 pp -87.79 -25.98 23.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.284 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.79 ' O ' HD12 ' A' ' 41' ' ' LEU . 4.7 mptt 58.55 179.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.974 0.416 . . . . 0.0 111.114 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.5 t70 70.13 149.12 0.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.749 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.595 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 62.47 24.76 66.2 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.375 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.454 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -54.3 -48.93 93.12 Favored Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 111.516 0.191 . . . . 0.0 111.516 -179.836 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 50.5 Cg_exo -53.79 -46.84 30.73 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.292 1.995 . . . . 0.0 112.581 -179.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -63.12 -50.44 70.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.412 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.901 HG11 HG11 ' A' ' 38' ' ' VAL . 11.9 t -65.11 -55.78 18.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.148 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.629 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 73.6 m-20 -54.07 -28.42 38.82 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.224 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.4 -49.54 33.07 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.416 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 28.4 mt-30 -74.15 -43.5 57.2 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.532 0.682 . . . . 0.0 109.588 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.605 HG13 HG12 ' A' ' 48' ' ' VAL . 1.2 mt -57.15 -36.2 50.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.376 179.273 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.933 ' HD2' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -69.08 -46.02 68.84 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.187 178.835 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.912 ' HA ' HD12 ' A' ' 57' ' ' ILE . 27.7 m-20 -51.19 -41.34 60.15 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.732 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.592 ' HB2' HD21 ' A' ' 31' ' ' LEU . 5.3 mt -69.25 -43.3 74.25 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 120.722 0.296 . . . . 0.0 110.351 179.33 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.443 ' N ' HD21 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -56.56 -36.43 69.31 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.606 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.933 HD11 ' HD2' ' A' ' 53' ' ' LYS . 10.9 mt -70.96 -42.25 77.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 115.096 -0.957 . . . . 0.0 110.171 178.702 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.904 ' O ' HD12 ' A' ' 62' ' ' LEU . 10.5 m -59.49 -46.12 89.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.419 179.433 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.779 HG23 HG12 ' A' ' 24' ' ' VAL . 46.3 mt -63.97 -53.49 43.37 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.527 179.443 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.435 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 96.0 m-20 -57.26 -34.19 68.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.301 179.437 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.88 -49.1 78.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.783 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.904 HD12 ' O ' ' A' ' 58' ' ' SER . 0.8 OUTLIER -55.78 -56.49 19.93 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.998 179.929 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.439 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.6 -53.78 8.62 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 123.198 0.311 . . . . 0.0 110.792 -179.92 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.07 -25.19 66.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.927 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.447 ' O ' HG23 ' A' ' 69' ' ' THR . 2.3 mtmp? -82.35 -30.42 30.38 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.137 0.494 . . . . 0.0 110.596 179.622 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.703 HG21 ' HG ' ' A' ' 21' ' ' LEU . 1.5 mm -71.22 -33.81 52.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.99 -179.495 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.81 0.95 57.51 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.214 -179.302 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.471 ' O ' HG22 ' A' ' 69' ' ' THR . 2.2 m -142.88 22.12 1.94 Allowed 'General case' 0 C--O 1.233 0.192 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.471 HG22 ' O ' ' A' ' 68' ' ' SER . 1.0 OUTLIER -160.34 157.4 27.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.605 179.206 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.63 36.49 1.77 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.49 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.7 138.71 55.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.071 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.43 HG22 ' H ' ' A' ' 74' ' ' GLU . 13.9 m -74.32 145.71 43.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.806 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.26 -30.61 62.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.668 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.43 ' H ' HG22 ' A' ' 72' ' ' THR . 1.4 tt0 -59.37 -45.1 92.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.427 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -60.24 -33.58 72.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.376 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.667 ' CD1' HD23 ' A' ' 62' ' ' LEU . 19.1 mm -70.88 -34.07 54.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.497 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -50.88 68.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.609 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.8 mmtm -61.14 -46.34 90.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.47 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -56.52 -33.47 66.08 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.925 ' O ' HG23 ' A' ' 84' ' ' VAL . 2.5 t80 -63.81 -38.08 89.78 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 177.719 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.6 -36.36 76.14 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.144 178.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.97 -37.36 76.6 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.253 0.549 . . . . 0.0 109.921 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.71 HD21 ' HB2' ' A' ' 58' ' ' SER . 24.8 mt -76.48 -30.08 57.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.112 178.894 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.925 HG23 ' O ' ' A' ' 80' ' ' TYR . 49.0 t -71.11 -34.66 55.74 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.543 179.426 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -72.02 -49.28 38.27 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.436 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.5 m -62.95 -40.81 98.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.28 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.404 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 3.0 m -62.93 -50.07 72.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.513 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -52.38 -41.75 63.39 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.021 0.439 . . . . 0.0 110.747 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -67.5 -32.74 73.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.688 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.515 HD23 HD12 ' A' ' 94' ' ' LEU . 5.1 tt -64.98 -47.08 78.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.964 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.75 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.7 mt -60.88 -48.79 80.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.238 0.542 . . . . 0.0 109.982 179.63 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.04 -42.69 72.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.334 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.91 -36.83 84.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.316 179.432 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.671 HD22 HD21 ' A' ' 41' ' ' LEU . 5.9 mt -66.91 -42.68 85.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.427 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.522 ' HA ' ' HD2' ' A' ' 98' ' ' LYS . 0.6 OUTLIER -55.95 -54.19 47.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.325 179.635 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.77 -28.74 69.66 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.261 179.187 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.3 tttm -66.63 -43.33 84.98 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.156 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.537 ' CE ' HD22 ' A' ' 41' ' ' LEU . 14.2 mttt -66.01 -53.66 35.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.223 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -25.53 67.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.719 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 -72.01 -53.33 13.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.903 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -144.88 145.39 31.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.882 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.94 -45.06 0.52 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.152 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.943 -179.966 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 . . . . . 0 C--O 1.233 0.208 0 CA-C-O 120.779 0.323 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 112.3 -144.63 17.85 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.559 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.01 -170.75 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.57 2.18 . . . . 0.0 112.389 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 83.77 142.89 5.27 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.359 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.41 ' O ' HG23 ' A' ' 24' ' ' VAL . 2.4 m 75.15 -58.05 0.58 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.672 0.272 . . . . 0.0 111.034 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.614 HD21 ' HB ' ' A' ' 66' ' ' ILE . 0.5 OUTLIER -53.67 -32.76 52.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.085 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.515 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.0 p -57.74 -48.35 83.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.303 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.515 ' N ' HG13 ' A' ' 22' ' ' VAL . 22.0 mttt -64.48 -41.92 96.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.888 0.375 . . . . 0.0 110.421 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.584 HG12 HG23 ' A' ' 59' ' ' ILE . 25.5 t -57.48 -48.49 82.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.703 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -59.35 -41.22 96.83 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.624 -0.798 . . . . 0.0 111.801 179.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.69 -36.3 74.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.905 0.383 . . . . 0.0 110.263 179.438 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.521 HD13 HD13 ' A' ' 83' ' ' LEU . 0.4 OUTLIER -64.59 -47.01 80.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.752 179.336 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.53 ' HA ' HD13 ' A' ' 59' ' ' ILE . 5.4 tttm -53.18 -36.37 60.86 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.465 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -68.72 -35.11 76.72 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.451 178.614 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -34.48 77.86 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.893 178.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.568 HD21 ' HB2' ' A' ' 55' ' ' LEU . 6.2 mp -63.71 -50.36 69.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.128 179.251 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -58.02 -35.76 71.73 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.19 179.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.9 tptt -60.4 -46.13 91.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.348 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.842 ' O ' HG23 ' A' ' 38' ' ' VAL . 21.3 m-85 -59.59 -42.7 93.14 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.49 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -58.28 -40.77 82.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.474 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -59.47 -49.74 76.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.508 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.4 t -63.2 -37.9 80.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.505 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.842 HG23 ' O ' ' A' ' 34' ' ' PHE . 57.2 t -68.23 -38.26 79.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.787 179.708 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.3 m -67.58 -30.72 70.41 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.738 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.57 -29.74 69.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.276 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.573 HD12 ' O ' ' A' ' 42' ' ' LYS . 1.2 pp -100.99 -22.52 14.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.208 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.573 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.2 OUTLIER 63.08 -173.82 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.912 179.902 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 62.24 155.46 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.758 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.811 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 63.7 33.16 86.51 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.319 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.568 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 16.8 mmtp -62.97 -55.29 38.98 Favored Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.568 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 10.0 Cg_endo -53.55 -43.03 61.13 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.561 2.174 . . . . 0.0 112.856 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -66.5 -41.02 89.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.786 0.327 . . . . 0.0 111.185 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 44' ' ' GLY . 47.4 t -71.19 -56.24 11.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.45 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.466 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 21.1 p30 -59.26 -25.46 64.08 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.946 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 11.1 ttt-85 -72.92 -47.14 48.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.778 0.323 . . . . 0.0 111.386 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -76.64 -46.05 27.46 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.421 0.629 . . . . 0.0 109.598 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.762 ' HA ' HD12 ' A' ' 55' ' ' LEU . 1.8 mt -57.39 -34.09 45.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.372 179.109 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.688 ' HG3' HD11 ' A' ' 57' ' ' ILE . 4.9 tptt -69.41 -52.36 27.69 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.534 179.245 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.927 ' HA ' HD12 ' A' ' 57' ' ' ILE . 4.9 m120 -51.52 -34.16 34.94 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.539 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.762 HD12 ' HA ' ' A' ' 52' ' ' ILE . 2.9 mt -76.63 -43.26 39.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.392 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.567 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -56.71 -35.0 68.01 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.415 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.927 HD12 ' HA ' ' A' ' 54' ' ' ASN . 14.0 mt -70.49 -43.49 77.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.187 178.728 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.887 ' O ' HD12 ' A' ' 62' ' ' LEU . 6.7 t -57.91 -45.92 85.77 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.681 179.576 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.584 HG23 HG12 ' A' ' 24' ' ' VAL . 13.9 mt -59.94 -54.47 34.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.757 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -57.54 -33.52 68.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.622 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.81 -49.55 77.27 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.474 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.887 HD12 ' O ' ' A' ' 58' ' ' SER . 1.5 mp -55.73 -55.03 37.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.695 179.283 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.494 ' HE2' HG11 ' A' ' 24' ' ' VAL . 9.3 tpp -45.12 -55.57 5.56 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.267 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.89 -24.24 66.82 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.805 0.336 . . . . 0.0 110.546 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.6 mtmm -82.25 -28.91 31.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.473 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.653 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.1 mm -71.88 -40.65 68.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.336 -179.386 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -92.56 -29.05 16.38 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.773 -179.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.762 ' O ' HG23 ' A' ' 69' ' ' THR . 1.2 t -103.14 24.41 10.89 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.714 0.264 . . . . 0.0 111.714 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.762 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 177.53 150.14 0.18 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.156 179.623 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 11.0 ttp -75.17 64.37 1.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.872 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.515 ' CE ' HD13 ' A' ' 76' ' ' ILE . 0.5 OUTLIER -62.63 124.49 21.12 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.779 179.992 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.8 m -77.11 136.38 38.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.771 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.3 mtm180 -52.77 -35.29 56.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.911 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -59.94 -42.34 93.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.458 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -67.22 -32.59 73.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.515 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.564 HD13 HD23 ' A' ' 62' ' ' LEU . 27.1 mm -70.11 -37.13 71.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.828 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -65.1 -50.36 66.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.692 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -63.57 -46.9 83.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.675 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.427 ' O ' HD12 ' A' ' 83' ' ' LEU . 1.1 mt-10 -56.46 -34.0 66.45 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.933 ' O ' HG23 ' A' ' 84' ' ' VAL . 3.5 t80 -64.15 -37.36 87.16 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.61 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -69.72 -36.8 76.2 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.17 178.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.74 -39.89 78.41 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.249 0.547 . . . . 0.0 109.681 179.051 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.716 HD21 ' HB3' ' A' ' 58' ' ' SER . 1.4 mt -74.34 -30.19 61.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.062 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.933 HG23 ' O ' ' A' ' 80' ' ' TYR . 57.3 t -70.2 -36.2 66.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.413 179.322 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.71 -49.43 58.97 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.204 179.467 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.439 ' CB ' HD21 ' A' ' 55' ' ' LEU . 58.5 m -63.95 -43.6 95.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.982 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.43 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 67.3 m -60.98 -50.0 75.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.338 179.329 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -50.3 -43.66 53.76 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.637 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -37.28 86.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.464 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.525 HD23 ' C ' ' A' ' 90' ' ' LEU . 5.9 tt -62.98 -44.14 96.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.929 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.489 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.5 mt -62.63 -48.67 78.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.08 0.466 . . . . 0.0 109.918 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.2 t -57.2 -43.58 82.85 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.645 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.07 -46.17 82.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.797 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.515 ' CD2' HG22 ' A' ' 38' ' ' VAL . 3.4 tp -61.67 -44.97 95.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.827 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.83 -44.86 78.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.775 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -58.4 -48.92 79.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.524 179.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt -55.14 -39.33 69.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.217 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.4 ' HE3' HD22 ' A' ' 41' ' ' LEU . 3.8 mttt -65.02 -54.04 36.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.047 0.451 . . . . 0.0 110.882 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -62.0 -25.46 67.65 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.515 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.81 -47.24 54.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.931 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 58.06 171.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.854 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -111.51 -28.35 8.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.049 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.992 -179.796 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.881 0.372 . . . . 0.0 110.785 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -73.44 130.27 13.22 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.386 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.755 ' HB3' HD12 ' A' ' 21' ' ' LEU . 51.0 Cg_exo -55.53 86.91 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.464 2.109 . . . . 0.0 112.272 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.36 56.66 0.59 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.391 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.699 ' O ' HG23 ' A' ' 24' ' ' VAL . 2.1 m -165.91 -41.7 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.806 0.336 . . . . 0.0 110.971 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.755 HD12 ' HB3' ' A' ' 18' ' ' PRO . 17.7 mt -53.85 -32.86 54.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.109 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.507 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.9 p -63.99 -46.78 93.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.1 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.507 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -65.71 -46.76 77.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.06 0.457 . . . . 0.0 110.614 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.816 HG12 HG23 ' A' ' 59' ' ' ILE . 6.3 t -57.0 -44.39 82.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.357 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.4 -38.24 95.41 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.646 -0.788 . . . . 0.0 111.574 179.154 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.7 -42.92 84.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.973 0.416 . . . . 0.0 110.102 179.232 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.55 ' O ' HD13 ' A' ' 27' ' ' LEU . 1.5 tm? -61.59 -43.73 98.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.105 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.86 -39.54 62.65 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 178.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.83 -36.83 85.59 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.579 178.531 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.06 -33.1 75.23 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.901 178.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.427 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 2.2 mp -62.74 -52.54 62.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.284 179.331 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.77 -36.1 71.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.329 179.463 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.438 ' O ' HG23 ' A' ' 37' ' ' VAL . 5.0 tptm -59.63 -44.67 93.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.411 179.508 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.839 ' O ' HG23 ' A' ' 38' ' ' VAL . 11.5 m-85 -60.93 -43.22 98.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.509 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.24 -46.7 72.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.793 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -58.73 -51.39 70.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.891 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 33' ' ' LYS . 21.7 t -61.32 -40.24 85.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.992 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.876 HG11 HG21 ' A' ' 48' ' ' VAL . 56.2 t -68.0 -39.76 82.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.93 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.5 t -69.12 -25.19 64.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.929 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.21 -32.21 64.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.391 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.746 HD12 ' O ' ' A' ' 42' ' ' LYS . 1.7 pp -96.39 -21.64 17.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.34 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.746 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.1 OUTLIER 60.62 -174.97 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.039 179.862 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.4 t70 70.82 139.14 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.855 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.729 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 60.71 60.35 8.62 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.269 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.485 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 13.9 mmtp -83.68 -46.01 0.79 Allowed Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 111.398 0.147 . . . . 0.0 111.398 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.485 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.9 Cg_exo -53.29 -41.32 73.46 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.322 2.015 . . . . 0.0 112.446 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -67.8 -39.51 83.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.922 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.876 HG21 HG11 ' A' ' 38' ' ' VAL . 33.6 t -70.82 -56.36 11.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.324 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.419 ' O ' ' CG ' ' A' ' 53' ' ' LYS . 15.4 p30 -60.28 -25.33 65.65 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.018 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 7.4 tpp180 -73.55 -43.57 59.58 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.761 0.315 . . . . 0.0 111.405 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.428 ' HA ' ' ND2' ' A' ' 54' ' ' ASN . 3.2 mt-30 -81.31 -44.71 17.26 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.367 0.603 . . . . 0.0 110.0 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.585 HG13 ' O ' ' A' ' 48' ' ' VAL . 2.3 mt -58.09 -40.99 79.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.63 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.474 ' HD3' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -70.5 -50.8 34.04 Favored 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.954 ' HA ' HD12 ' A' ' 57' ' ' ILE . 30.2 p30 -59.68 -25.42 64.73 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.086 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.726 HD22 HD23 ' A' ' 83' ' ' LEU . 50.7 mt -80.02 -43.95 21.01 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.097 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.6 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -56.75 -34.75 67.87 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.412 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.954 HD12 ' HA ' ' A' ' 54' ' ' ASN . 13.3 mt -71.1 -43.5 75.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.1 178.744 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.696 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.0 OUTLIER -58.53 -47.35 84.46 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.334 179.422 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.816 HG23 HG12 ' A' ' 24' ' ' VAL . 9.9 mt -58.44 -53.04 52.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.717 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -59.4 -33.85 71.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.624 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.62 -50.43 73.18 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.978 0.418 . . . . 0.0 110.316 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.696 HD12 ' O ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -56.32 -54.93 39.6 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.306 179.071 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.497 ' HE1' ' HB ' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -44.89 -57.48 3.75 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.191 -179.87 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.45 -24.87 63.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.957 0.408 . . . . 0.0 110.701 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 24.0 mtpt -82.27 -29.59 31.14 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.577 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -72.79 -35.33 49.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.202 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.01 1.26 57.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.16 -179.101 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.444 ' O ' HG22 ' A' ' 69' ' ' THR . 1.4 m -136.22 21.09 3.2 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.945 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.444 HG22 ' O ' ' A' ' 68' ' ' SER . 1.4 p -160.05 -168.35 2.19 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.949 0.404 . . . . 0.0 110.626 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 5.0 tpt -130.92 37.21 3.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.459 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 33.3 mtp -56.61 139.63 49.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.01 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.8 m -74.53 144.08 44.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.715 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.9 mtt180 -55.04 -30.41 59.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.584 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.88 -44.16 86.5 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.249 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -36.29 79.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.021 179.319 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.61 ' CD1' HD23 ' A' ' 62' ' ' LEU . 23.0 mm -71.19 -34.06 53.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.368 179.31 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -52.01 67.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.443 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 mppp? -61.91 -46.4 89.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.33 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.417 ' OE1' HD11 ' A' ' 62' ' ' LEU . 2.9 mt-10 -56.43 -33.78 66.17 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.521 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.901 ' O ' HG23 ' A' ' 84' ' ' VAL . 12.0 t80 -63.54 -37.47 87.44 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.665 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -69.59 -36.2 76.03 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.801 178.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.56 -35.6 74.56 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-O 121.136 0.493 . . . . 0.0 109.728 178.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.726 HD23 HD22 ' A' ' 55' ' ' LEU . 1.6 mt -77.13 -31.58 55.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.062 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.901 HG23 ' O ' ' A' ' 80' ' ' TYR . 41.4 t -71.34 -35.03 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.571 179.473 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.99 -47.32 52.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.598 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.5 m -69.88 -36.86 75.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.709 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.1 m -65.08 -50.46 66.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.697 179.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -39.35 82.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.647 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -65.83 -31.17 71.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.561 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.516 HD23 HD23 ' A' ' 91' ' ' LEU . 6.2 tt -66.67 -48.19 70.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.697 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.516 HD23 HD23 ' A' ' 90' ' ' LEU . 5.8 mt -64.99 -46.64 80.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.168 0.508 . . . . 0.0 109.89 179.331 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.87 -35.43 70.95 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.636 179.553 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.43 -37.61 77.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.669 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.719 HD22 HD21 ' A' ' 41' ' ' LEU . 2.7 mt -71.42 -43.34 66.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.624 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -54.11 48.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.773 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.3 -34.92 77.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.138 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -62.42 -36.6 82.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.525 179.377 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.408 ' HE3' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -66.46 -53.58 33.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.399 179.595 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -57.85 -25.58 60.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.63 179.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -74.82 -43.87 52.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.762 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 61.41 31.56 19.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.952 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -138.03 173.65 11.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.867 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.804 179.921 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.805 0.336 . . . . 0.0 110.949 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 163.6 -105.52 0.25 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.465 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.49 ' HA ' HD12 ' A' ' 21' ' ' LEU . 63.1 Cg_endo -73.44 -168.04 0.41 Allowed 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.538 2.159 . . . . 0.0 112.248 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.7 -73.87 0.64 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.713 -0.755 . . . . 0.0 112.546 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.3 p -60.17 -29.22 68.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.817 0.342 . . . . 0.0 111.028 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.49 HD12 ' HA ' ' A' ' 18' ' ' PRO . 10.9 mt -58.94 -32.77 69.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.006 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.7 t -61.71 -52.28 62.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.041 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -53.0 -41.24 64.46 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.999 0.428 . . . . 0.0 110.745 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.509 ' CG1' HG23 ' A' ' 59' ' ' ILE . 51.4 t -60.78 -49.73 83.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.332 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.19 -37.54 93.09 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.703 -0.76 . . . . 0.0 111.837 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.01 -46.86 82.02 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.912 0.387 . . . . 0.0 110.26 179.487 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.752 ' CD2' HD13 ' A' ' 83' ' ' LEU . 22.8 tp -62.01 -37.26 84.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.277 -0.419 . . . . 0.0 109.9 179.04 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.68 -38.89 70.23 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.581 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -38.65 88.29 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.672 178.563 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 20.1 mmt180 -59.8 -38.59 82.35 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.136 -0.483 . . . . 0.0 109.975 179.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.731 HD12 ' CD1' ' A' ' 59' ' ' ILE . 5.9 mt -62.5 -48.7 78.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.048 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.02 -38.06 75.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.087 179.255 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.41 ' HE3' ' CG2' ' A' ' 37' ' ' VAL . 5.2 tptt -58.9 -42.23 89.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.018 179.197 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.882 ' O ' HG23 ' A' ' 38' ' ' VAL . 21.3 m-85 -61.13 -43.95 98.09 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.25 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -54.56 -43.31 71.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.555 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.79 -52.61 64.99 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.393 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.41 ' CG2' ' HE3' ' A' ' 33' ' ' LYS . 24.0 t -59.31 -37.81 71.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.582 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.882 HG23 ' O ' ' A' ' 34' ' ' PHE . 41.0 t -70.07 -31.2 46.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.895 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.42 -27.64 61.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.593 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.35 -34.4 76.03 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.205 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.745 HD12 ' O ' ' A' ' 42' ' ' LYS . 1.8 pp -92.07 -20.19 21.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.245 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.745 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER 59.19 -173.55 0.1 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.866 0.365 . . . . 0.0 110.898 179.767 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 64.57 151.56 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.805 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.491 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 59.8 29.17 66.9 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.306 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.545 ' HZ1' HG12 ' A' ' 38' ' ' VAL . 0.4 OUTLIER -56.2 -57.55 21.91 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 120.494 0.188 . . . . 0.0 111.252 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 11.3 Cg_endo -54.96 -33.88 84.39 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.436 2.09 . . . . 0.0 112.228 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -67.07 -49.06 66.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.705 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.87 HG21 HG11 ' A' ' 38' ' ' VAL . 25.8 t -69.93 -55.17 15.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.95 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.595 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 65.3 m-20 -52.85 -32.87 46.92 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.684 0.278 . . . . 0.0 111.106 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.6 ttt85 -72.15 -46.21 57.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.869 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.45 ' NE2' HD12 ' A' ' 90' ' ' LEU . 9.3 pt20 -73.04 -45.59 56.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.657 0.741 . . . . 0.0 109.472 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.538 HG13 HG12 ' A' ' 48' ' ' VAL . 1.7 mt -57.56 -32.89 43.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.314 178.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.826 ' HD2' HD11 ' A' ' 57' ' ' ILE . 7.1 tmtm? -69.16 -49.8 53.49 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.343 178.834 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.946 ' HA ' HD12 ' A' ' 57' ' ' ILE . 16.9 m-20 -50.98 -39.84 56.43 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.578 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.674 ' HB3' HD11 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -71.17 -43.01 68.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.182 179.345 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.603 ' HG2' HD13 ' A' ' 31' ' ' LEU . 13.3 mm-40 -57.01 -36.79 70.84 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 178.385 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.946 HD12 ' HA ' ' A' ' 54' ' ' ASN . 12.2 mt -69.63 -42.1 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.173 178.736 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.655 ' O ' HD12 ' A' ' 62' ' ' LEU . 22.7 t -57.62 -51.52 69.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.192 179.463 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.731 ' CD1' HD12 ' A' ' 31' ' ' LEU . 5.9 mt -57.92 -46.49 87.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.281 179.221 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.8 -35.24 75.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.351 179.446 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.92 -49.81 75.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.283 179.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.657 HD23 ' CD1' ' A' ' 76' ' ' ILE . 1.6 mp -55.53 -54.0 49.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.439 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.42 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.15 -54.3 7.02 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.291 -179.907 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.95 -25.22 67.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.863 0.363 . . . . 0.0 110.685 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 25.0 mtpt -82.04 -28.66 32.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.565 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.656 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.7 mm -73.06 -38.06 54.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.43 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.15 -27.57 16.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.715 -179.218 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.78 ' O ' HG23 ' A' ' 69' ' ' THR . 1.4 m -105.88 25.33 11.03 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.78 HG23 ' O ' ' A' ' 68' ' ' SER . 0.3 OUTLIER 174.14 155.12 0.12 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.878 179.678 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.6 mmt -83.23 82.44 8.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.946 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -84.18 119.03 24.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.054 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.7 m -73.43 144.34 46.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.607 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -52.65 -34.07 49.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.948 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -58.25 -49.09 78.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.47 179.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.32 -34.35 72.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.179 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.843 HG22 ' CE2' ' A' ' 80' ' ' TYR . 21.9 mm -72.4 -34.19 47.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.574 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' ' 80' ' ' TYR . 3.2 tp-100 -60.54 -48.58 81.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.519 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.71 -45.74 85.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.35 179.526 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.91 -35.99 69.65 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 178.709 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.918 ' O ' HG23 ' A' ' 84' ' ' VAL . 9.5 m-85 -63.59 -35.08 79.31 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.554 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -68.92 -36.76 78.36 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.831 178.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.09 -35.16 76.25 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.261 0.553 . . . . 0.0 109.573 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.752 HD13 ' CD2' ' A' ' 27' ' ' LEU . 1.9 mt -76.56 -31.96 57.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.035 178.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.918 HG23 ' O ' ' A' ' 80' ' ' TYR . 49.3 t -69.15 -34.16 62.02 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.362 179.414 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.9 mmpt? -72.03 -49.12 39.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.426 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 m -68.27 -37.52 80.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.609 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 98.7 p -67.06 -49.08 66.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.663 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -55.88 -43.96 77.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.975 0.417 . . . . 0.0 110.779 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -67.29 -30.67 70.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.729 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.45 HD12 ' NE2' ' A' ' 51' ' ' GLN . 7.1 tt -63.17 -47.63 81.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.018 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.647 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.4 mt -63.54 -47.2 82.57 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.215 0.531 . . . . 0.0 109.84 179.383 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 49.4 m -58.31 -42.93 87.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.505 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.77 -33.49 75.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.566 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.634 HD11 HG13 ' A' ' 38' ' ' VAL . 11.9 tp -67.59 -49.18 64.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.669 179.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.426 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 2.5 mp0 -55.75 -47.0 77.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.597 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.1 pttp -65.34 -28.74 69.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.03 0.443 . . . . 0.0 109.825 178.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -70.41 -53.93 14.47 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.177 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.426 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 0.0 OUTLIER -64.07 -41.23 97.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.846 0.355 . . . . 0.0 110.929 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -64.69 -33.69 76.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.672 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -78.09 -28.83 48.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.132 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -52.81 102.15 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.098 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -119.87 -27.42 5.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.277 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.176 -179.83 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.88 0.371 . . . . 0.0 110.796 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -72.12 -170.06 13.58 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.601 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -55.73 -61.85 0.32 Allowed 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.661 2.241 . . . . 0.0 112.295 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.58 -78.97 1.79 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.602 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.9 p -105.49 -26.39 11.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.74 0.305 . . . . 0.0 110.993 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.487 HD21 ' HB ' ' A' ' 66' ' ' ILE . 3.5 mt -55.11 -32.5 62.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.165 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.5 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.5 p -51.78 -46.99 40.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.36 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.5 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.5 OUTLIER -63.69 -43.83 95.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.14 0.495 . . . . 0.0 110.371 179.687 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.523 ' CG1' HG23 ' A' ' 59' ' ' ILE . 21.1 t -57.61 -44.47 85.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.492 179.357 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.16 -38.57 96.38 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.716 179.301 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.82 -46.06 81.88 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.079 0.466 . . . . 0.0 110.096 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.871 HD23 HG12 ' A' ' 59' ' ' ILE . 9.5 tp -62.12 -37.19 84.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.883 178.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.56 -38.77 69.76 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.671 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -38.01 84.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.706 178.651 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -61.22 -37.17 82.07 Favored 'General case' 0 N--CA 1.458 -0.068 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.178 179.336 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.655 HD23 HD11 ' A' ' 59' ' ' ILE . 2.6 mm? -63.91 -52.19 61.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.174 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.04 -32.43 67.97 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.303 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.6 tptt -63.07 -45.13 93.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.326 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.848 ' O ' HG23 ' A' ' 38' ' ' VAL . 13.3 m-85 -60.4 -43.4 96.7 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.59 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -57.33 -42.64 82.31 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.726 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.01 -52.45 65.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.715 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.42 ' O ' HD23 ' A' ' 41' ' ' LEU . 21.7 t -60.95 -37.95 78.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.871 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.924 HG22 HD21 ' A' ' 94' ' ' LEU . 56.1 t -70.09 -32.77 52.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.037 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -72.68 -29.32 63.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.861 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.05 -28.73 64.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.21 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.867 HD12 ' O ' ' A' ' 42' ' ' LYS . 2.2 pp -101.49 -24.25 14.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.202 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.867 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER 60.49 -169.7 0.15 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.816 179.88 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 64.51 136.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.76 -179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.887 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 72.2 26.16 72.84 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.327 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.564 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 1.9 mmtt -56.53 -55.72 39.73 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.52 0.2 . . . . 0.0 111.354 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.564 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 9.8 Cg_endo -53.49 -44.15 51.48 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.348 2.032 . . . . 0.0 112.275 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.88 -49.45 77.41 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.034 0.445 . . . . 0.0 110.511 179.664 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 44' ' ' GLY . 17.8 t -60.9 -55.28 25.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.756 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.412 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 42.5 m-20 -54.83 -25.61 29.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.115 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -50.41 28.63 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.843 0.354 . . . . 0.0 111.555 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -74.89 -45.17 44.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.496 0.665 . . . . 0.0 109.398 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.699 HG12 HD11 ' A' ' 90' ' ' LEU . 1.5 mt -57.81 -32.35 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.276 178.787 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.572 ' HG2' HD11 ' A' ' 57' ' ' ILE . 26.9 tttt -69.35 -52.75 24.19 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.429 179.242 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.938 ' HA ' HD12 ' A' ' 57' ' ' ILE . 6.3 m120 -50.95 -39.3 54.64 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.743 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 1.041 HD13 HD23 ' A' ' 83' ' ' LEU . 0.3 OUTLIER -70.65 -43.68 68.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.283 179.592 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.72 -35.87 69.04 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.53 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.938 HD12 ' HA ' ' A' ' 54' ' ' ASN . 11.9 mt -71.12 -42.56 75.9 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.31 178.723 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.838 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.1 m -58.89 -49.68 76.88 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.406 179.5 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.871 HG12 HD23 ' A' ' 27' ' ' LEU . 36.0 mt -60.79 -53.49 48.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.552 179.567 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.84 -34.69 71.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.503 179.623 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.67 -49.7 75.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.269 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.838 HD12 ' O ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -55.76 -54.67 41.53 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.405 179.186 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.463 ' HE1' ' HB ' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.0 -58.08 3.41 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.218 -179.899 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.17 -24.53 63.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.881 0.372 . . . . 0.0 110.552 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.442 ' O ' HG23 ' A' ' 69' ' ' THR . 0.0 OUTLIER -82.14 -29.44 31.62 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.633 179.496 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.646 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -73.0 -34.84 47.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.278 -179.443 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -87.61 -28.28 22.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.973 -179.163 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.485 ' O ' HG22 ' A' ' 69' ' ' THR . 48.0 t -101.31 17.63 22.1 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.485 HG22 ' O ' ' A' ' 68' ' ' SER . 0.8 OUTLIER -161.46 -168.02 1.89 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.612 179.376 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.83 39.06 3.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.232 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -51.66 152.7 2.68 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.328 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.7 m -86.12 147.41 26.17 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.803 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -30.93 65.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.585 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -46.28 88.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.282 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -60.42 -33.77 73.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.368 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.595 ' CD1' HD23 ' A' ' 62' ' ' LEU . 23.0 mm -71.07 -35.13 57.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.46 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -62.39 -45.46 93.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.562 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.8 tptp -67.01 -49.03 66.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.449 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.541 ' O ' HD12 ' A' ' 83' ' ' LEU . 49.5 mt-10 -56.73 -34.1 67.18 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.919 ' O ' HG23 ' A' ' 84' ' ' VAL . 15.4 t80 -64.8 -35.64 81.73 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.42 -0.955 . . . . 0.0 108.42 177.669 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.52 -36.92 76.86 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.896 178.608 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.23 -36.87 78.71 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 178.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 1.041 HD23 HD13 ' A' ' 55' ' ' LEU . 1.3 mt -75.75 -31.75 59.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.944 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.919 HG23 ' O ' ' A' ' 80' ' ' TYR . 87.9 t -67.13 -34.17 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.23 179.292 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 16.2 tptt -72.13 -49.36 36.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.095 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.477 ' HB3' HD11 ' A' ' 55' ' ' LEU . 1.1 t -61.78 -40.84 96.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.323 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.7 p -64.41 -48.95 73.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.438 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.91 -44.04 49.93 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.595 179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.18 -29.72 66.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.564 179.439 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.699 HD11 HG12 ' A' ' 52' ' ' ILE . 9.1 tt -65.43 -48.96 70.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.807 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.492 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.6 mt -62.33 -45.63 92.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.203 0.525 . . . . 0.0 109.665 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 60.3 p -54.79 -42.94 72.4 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.382 179.374 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.06 -45.23 94.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.43 179.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.924 HD21 HG22 ' A' ' 38' ' ' VAL . 0.5 OUTLIER -54.93 -49.11 72.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.239 179.442 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -56.4 -38.69 71.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.414 179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.62 -32.27 73.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.029 179.14 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -69.55 -58.18 4.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.249 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.55 -45.87 88.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.343 -179.463 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -62.88 -35.85 81.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.865 0.364 . . . . 0.0 110.875 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -70.43 -52.91 18.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.904 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -60.99 -72.4 0.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.864 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -94.13 -177.57 4.34 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.834 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.723 179.987 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.712 0.291 . . . . 0.0 111.001 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.727 ' HG ' HG21 ' A' ' 66' ' ' ILE . 1.3 mt -55.18 -32.81 62.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.004 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.501 HG13 ' N ' ' A' ' 23' ' ' LYS . 11.3 p -53.33 -46.0 57.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.309 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.501 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -59.66 -46.31 89.43 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.027 0.441 . . . . 0.0 110.537 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.49 ' CG1' HG23 ' A' ' 59' ' ' ILE . 20.6 t -56.92 -43.82 81.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.665 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -63.71 -37.53 94.86 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.644 -0.789 . . . . 0.0 111.891 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.06 -47.94 79.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.895 0.379 . . . . 0.0 110.224 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.623 HD12 ' CE2' ' A' ' 80' ' ' TYR . 0.8 OUTLIER -61.22 -41.02 96.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.072 179.387 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.06 -38.58 62.6 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 mptt -65.85 -40.54 91.8 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.496 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.4 mmt85 -63.06 -33.3 75.15 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.775 178.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.578 HD12 ' CD1' ' A' ' 59' ' ' ILE . 0.4 OUTLIER -62.58 -49.25 75.98 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.218 179.281 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.91 -37.58 74.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.162 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 tptm -59.02 -43.5 91.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.288 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.822 ' O ' HG23 ' A' ' 38' ' ' VAL . 14.1 m-85 -62.47 -40.53 96.96 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.324 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.06 -45.41 79.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.668 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -59.67 -55.27 36.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.575 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 24.1 t -56.08 -38.0 51.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.933 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 1.026 HG11 HG11 ' A' ' 48' ' ' VAL . 49.2 t -75.25 -33.19 27.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.87 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.03 -32.52 73.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.43 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -83.08 -1.79 53.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.537 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.2 mt -89.54 -56.18 3.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.793 0.33 . . . . 0.0 111.006 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.04 3.66 4.45 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.652 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -116.69 138.34 51.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.771 0.32 . . . . 0.0 110.761 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.785 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 58.18 52.05 54.83 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.275 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.506 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 5.8 mmtm -72.05 -43.19 10.32 Favored Pre-proline 0 C--N 1.329 -0.289 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.506 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.5 Cg_exo -53.42 -48.92 19.33 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.226 1.95 . . . . 0.0 112.771 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -65.46 -38.68 90.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.531 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.026 HG11 HG11 ' A' ' 38' ' ' VAL . 25.8 t -72.4 -56.95 8.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.621 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.573 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 28.5 p30 -58.95 -26.17 64.18 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.067 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 54.7 ttm-85 -73.69 -46.37 46.69 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.97 0.414 . . . . 0.0 111.504 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -74.96 -47.44 29.43 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.525 0.679 . . . . 0.0 109.203 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.621 HG13 ' O ' ' A' ' 48' ' ' VAL . 3.7 mt -57.91 -30.92 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.759 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.25 178.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.573 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -70.23 -55.16 9.97 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.594 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.78 ' HA ' HD12 ' A' ' 57' ' ' ILE . 28.2 p30 -59.73 -25.7 65.03 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 120.871 -0.331 . . . . 0.0 111.181 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.845 ' O ' HD12 ' A' ' 59' ' ' ILE . 45.5 mt -77.44 -46.51 22.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.746 0.308 . . . . 0.0 110.226 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.441 ' HG2' HD13 ' A' ' 31' ' ' LEU . 0.5 OUTLIER -56.69 -37.72 71.27 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.634 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.78 HD12 ' HA ' ' A' ' 54' ' ' ASN . 9.7 mt -71.4 -39.93 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.109 178.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.675 ' O ' HD12 ' A' ' 62' ' ' LEU . 16.1 t -57.76 -55.12 38.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.506 179.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.845 HD12 ' O ' ' A' ' 55' ' ' LEU . 2.7 mp -58.87 -47.8 88.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.424 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -60.31 -33.95 73.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.352 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.58 -49.5 77.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.327 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.675 HD12 ' O ' ' A' ' 58' ' ' SER . 1.5 mp -55.5 -52.9 62.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.467 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.476 ' HE1' ' HB ' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.25 -54.07 7.51 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.111 179.769 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.45 -24.83 67.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.598 179.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -81.9 -29.11 32.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.336 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.727 HG21 ' HG ' ' A' ' 21' ' ' LEU . 1.9 mm -71.98 -37.63 61.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.031 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.86 -27.96 16.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.571 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.766 ' O ' HG23 ' A' ' 69' ' ' THR . 1.6 t -104.12 24.54 11.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.704 0.288 . . . . 0.0 111.58 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.766 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 175.89 150.05 0.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.823 179.512 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.7 mtt -83.94 72.91 10.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.916 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 8.3 mmm -74.62 138.81 43.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.688 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.2 m -78.06 139.37 39.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.855 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -55.48 -35.02 65.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.665 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -58.27 -44.47 88.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.351 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -61.67 -32.86 73.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.285 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.591 HD13 HD23 ' A' ' 62' ' ' LEU . 22.8 mm -73.1 -36.65 51.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.742 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 37.5 tp60 -60.22 -52.28 65.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.667 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.53 -46.3 86.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.432 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.56 ' CD ' HD21 ' A' ' 62' ' ' LEU . 19.2 mt-10 -56.7 -34.21 67.21 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 178.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.902 ' O ' HG23 ' A' ' 84' ' ' VAL . 36.5 t80 -64.5 -36.28 83.67 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.44 -37.07 77.22 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.89 178.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.58 -36.07 75.52 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.257 0.551 . . . . 0.0 109.642 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 20.9 mt -76.1 -31.66 58.8 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.066 178.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.902 HG23 ' O ' ' A' ' 80' ' ' TYR . 51.1 t -69.41 -34.43 62.26 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.518 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 18.2 mmtt -71.98 -49.18 39.47 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.357 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.572 ' HB3' HD21 ' A' ' 55' ' ' LEU . 0.3 OUTLIER -67.68 -42.28 82.37 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.463 179.532 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.411 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 72.6 m -65.08 -47.2 78.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.475 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -54.3 -44.67 72.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.623 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.64 -35.03 79.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.61 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.426 HD23 HD23 ' A' ' 91' ' ' LEU . 5.3 tt -60.24 -45.91 91.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.849 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.426 HD23 HD23 ' A' ' 90' ' ' LEU . 7.1 mt -61.58 -51.95 66.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.069 0.462 . . . . 0.0 109.809 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.1 m -56.11 -41.28 75.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.353 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.21 -40.51 90.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.547 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 1.007 HD21 HG22 ' A' ' 38' ' ' VAL . 5.4 mp -63.85 -44.14 94.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.417 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -55.85 -50.63 70.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.679 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 16.3 pttp -62.39 -28.65 69.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.101 0.477 . . . . 0.0 109.782 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.417 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.514 ' O ' HG23 ' A' ' 24' ' ' VAL . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.111 0 CA-C-O 120.647 0.26 . . . . 0.0 111.104 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.2 mp -53.89 -32.71 54.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.129 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.536 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.8 p -55.35 -49.68 71.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.268 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.536 ' N ' HG13 ' A' ' 22' ' ' VAL . 35.3 mttt -68.92 -43.91 74.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.897 0.379 . . . . 0.0 110.48 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 20' ' ' SER . 21.0 t -57.12 -40.18 71.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.286 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.53 -39.73 94.04 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.679 -0.772 . . . . 0.0 111.614 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -32.52 72.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.896 0.379 . . . . 0.0 110.087 179.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.686 HD13 HD13 ' A' ' 83' ' ' LEU . 0.3 OUTLIER -68.1 -49.9 58.25 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.772 179.137 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -52.99 -33.39 51.27 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.96 -39.3 79.56 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.416 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.445 ' HG3' ' CZ ' ' A' ' 34' ' ' PHE . 2.0 tpt180 -64.12 -31.97 73.36 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.442 ' CD1' HD12 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -65.96 -46.25 78.79 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.066 179.097 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -58.06 -37.37 74.3 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.859 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -59.75 -49.78 76.4 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.949 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.743 ' O ' HG23 ' A' ' 38' ' ' VAL . 11.3 m-85 -60.82 -37.87 83.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.38 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 27.3 m-80 -58.4 -43.54 88.61 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.411 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -51.15 71.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.147 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 36.8 t -57.46 -37.71 59.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.333 179.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.842 ' HA ' HD12 ' A' ' 41' ' ' LEU . 95.5 t -68.57 -41.84 83.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.639 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.8 t -58.17 -34.35 70.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.672 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -86.5 -16.15 37.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.326 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.842 HD12 ' HA ' ' A' ' 38' ' ' VAL . 12.4 mt -74.53 -50.67 17.21 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.167 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 0.1 OUTLIER 67.19 10.47 7.74 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.716 -179.706 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -131.4 152.92 50.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.729 0.299 . . . . 0.0 110.908 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 56.47 33.11 61.68 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.359 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.535 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 17.8 mmtt -53.54 -57.1 18.58 Favored Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 111.53 0.196 . . . . 0.0 111.53 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 14.2 Cg_endo -57.41 -41.76 68.94 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.391 2.061 . . . . 0.0 113.004 -179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -64.96 -50.77 65.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.841 0.353 . . . . 0.0 111.509 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.539 ' O ' HG13 ' A' ' 52' ' ' ILE . 8.4 p -69.2 -49.74 58.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.703 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.521 ' N ' HG13 ' A' ' 48' ' ' VAL . 44.8 p30 -61.83 -25.14 67.33 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.105 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.438 ' N ' ' OD1' ' A' ' 49' ' ' ASN . 1.0 OUTLIER -73.47 -47.76 38.85 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.808 0.337 . . . . 0.0 111.097 179.875 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -74.76 -46.62 35.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.509 0.671 . . . . 0.0 109.382 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.898 HD11 HD11 ' A' ' 90' ' ' LEU . 1.4 mt -57.27 -32.57 41.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 CA-C-N 114.801 -1.09 . . . . 0.0 110.299 178.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 9.0 tttt -69.29 -53.26 20.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.348 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.93 ' HA ' HD12 ' A' ' 57' ' ' ILE . 9.4 m-20 -53.78 -29.22 39.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.83 0.348 . . . . 0.0 110.861 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.89 HD12 ' HA ' ' A' ' 52' ' ' ILE . 4.1 mt -77.16 -47.92 19.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.243 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' A' ' 57' ' ' ILE . 0.0 OUTLIER -56.39 -31.3 63.71 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 178.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.93 HD12 ' HA ' ' A' ' 54' ' ' ASN . 14.8 mt -71.6 -43.57 71.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.107 178.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.747 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.2 m -58.35 -53.14 61.69 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.772 179.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.442 HD12 ' CD1' ' A' ' 31' ' ' LEU . 23.0 mt -57.04 -52.43 56.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.791 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.4 -33.79 68.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.306 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -58.63 -49.35 77.82 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.107 179.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.747 HD12 ' O ' ' A' ' 58' ' ' SER . 1.9 mp -55.34 -53.22 58.96 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.446 179.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.461 ' HE3' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.4 -53.05 9.19 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.042 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.4 ' O ' ' CB ' ' A' ' 68' ' ' SER . . . -63.27 -25.09 68.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.653 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 26.4 mtpt -82.03 -28.87 32.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.132 0.491 . . . . 0.0 110.641 179.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.653 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.0 mm -71.49 -41.84 72.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.394 -179.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.66 -29.12 16.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.799 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.782 ' O ' HG23 ' A' ' 69' ' ' THR . 0.3 OUTLIER -101.41 21.8 13.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.527 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.782 HG23 ' O ' ' A' ' 68' ' ' SER . 0.5 OUTLIER 178.05 155.88 0.38 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.93 179.502 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.97 81.65 4.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.801 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.4 mmm -86.68 141.44 28.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.948 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.8 m -77.96 139.89 39.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.924 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -53.99 -31.99 52.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.95 0.405 . . . . 0.0 110.878 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -59.3 -49.09 79.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.535 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -61.87 -32.3 72.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.44 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.584 ' CD1' HD23 ' A' ' 62' ' ' LEU . 20.5 mm -71.75 -33.94 50.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.74 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -46.6 76.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.926 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 21.8 mmtt -63.4 -51.25 66.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.75 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -56.3 -33.71 65.82 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.923 ' O ' HG23 ' A' ' 84' ' ' VAL . 2.9 t80 -64.44 -36.19 83.37 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.36 -36.65 77.06 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.959 178.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.91 -39.13 80.58 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 121.285 0.565 . . . . 0.0 109.644 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.686 HD13 HD13 ' A' ' 27' ' ' LEU . 2.1 mt -75.13 -29.49 60.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.095 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.923 HG23 ' O ' ' A' ' 80' ' ' TYR . 64.0 t -71.04 -37.4 67.35 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.269 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -49.31 64.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.181 179.397 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.589 ' HB3' HD21 ' A' ' 55' ' ' LEU . 0.2 OUTLIER -67.03 -35.52 80.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.145 179.287 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.435 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 7.3 t -65.69 -46.84 77.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.439 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.588 ' OE1' HG12 ' A' ' 84' ' ' VAL . 25.8 mt-10 -56.13 -47.24 78.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.117 0.484 . . . . 0.0 110.649 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.44 -31.37 72.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.735 179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.898 HD11 HD11 ' A' ' 52' ' ' ILE . 4.6 tt -63.99 -42.2 97.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.954 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.4 mt -64.6 -50.34 67.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.201 0.524 . . . . 0.0 110.016 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.6 m -59.08 -39.18 81.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.838 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.4 -53.27 17.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.098 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.494 HD21 HG22 ' A' ' 38' ' ' VAL . 7.1 mp -58.33 -33.59 69.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.024 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.98 -51.78 50.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.851 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 10.0 pttp -57.53 -28.46 63.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.188 0.518 . . . . 0.0 110.078 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.8 mttp . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.946 -179.806 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 86.2 p . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.807 0.337 . . . . 0.0 110.843 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.453 HD21 ' HB ' ' A' ' 66' ' ' ILE . 27.9 mt -54.83 -32.89 61.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.945 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.491 HG13 ' N ' ' A' ' 23' ' ' LYS . 12.3 p -59.11 -45.65 92.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.228 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.491 ' N ' HG13 ' A' ' 22' ' ' VAL . 8.0 mmtt -57.98 -44.59 87.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.059 0.457 . . . . 0.0 110.661 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.44 HG12 ' CG2' ' A' ' 59' ' ' ILE . 14.9 t -56.81 -44.93 82.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.612 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.73 -37.45 94.29 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.721 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.1 m -57.01 -47.27 81.24 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.993 0.425 . . . . 0.0 110.35 179.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.64 HD13 ' CE2' ' A' ' 80' ' ' TYR . 5.1 tp -60.74 -41.4 95.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.166 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -54.37 -36.82 64.29 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.96 -38.71 86.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.681 178.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 mpt_? -63.18 -34.87 78.58 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.89 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.55 HD12 HD12 ' A' ' 59' ' ' ILE . 13.2 mt -63.17 -49.71 73.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.197 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.99 -36.86 73.24 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.11 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.0 tptm -59.32 -44.36 92.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.236 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.815 ' O ' HG23 ' A' ' 38' ' ' VAL . 7.6 m-85 -62.57 -37.59 86.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.165 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -58.71 -41.6 86.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.439 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.86 -55.15 32.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.495 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.6 t -55.83 -37.87 49.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.573 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 1.024 HG21 HG11 ' A' ' 48' ' ' VAL . 61.1 t -74.22 -35.07 39.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.519 179.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -35.3 71.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.196 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.2 -31.0 68.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.838 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.534 ' O ' HD12 ' A' ' 41' ' ' LEU . 1.3 pp -117.31 80.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.743 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.74 -27.64 5.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.245 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -58.64 98.9 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.877 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.555 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 95.66 40.45 4.14 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.5 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.451 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -71.58 -49.98 10.81 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.605 0.24 . . . . 0.0 111.181 -179.952 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.451 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.1 Cg_exo -53.28 -40.36 77.98 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.427 2.085 . . . . 0.0 112.657 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -59.93 -50.56 73.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.02 0.438 . . . . 0.0 110.817 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.024 HG11 HG21 ' A' ' 38' ' ' VAL . 4.0 t -66.2 -55.32 19.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.749 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.583 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 83.9 m-20 -52.92 -27.86 20.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.049 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 48.8 ttt-85 -71.75 -53.4 13.55 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.916 0.388 . . . . 0.0 111.899 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.4 ' HA ' HD21 ' A' ' 54' ' ' ASN . 6.0 mt-30 -69.74 -43.84 71.47 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.786 0.803 . . . . 0.0 109.082 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.601 HG13 HG12 ' A' ' 48' ' ' VAL . 1.4 mt -59.52 -29.99 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.869 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.212 178.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.583 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -69.94 -55.11 10.51 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.403 179.717 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.899 ' HA ' HD12 ' A' ' 57' ' ' ILE . 27.5 p30 -60.19 -25.7 65.78 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.917 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.487 HD22 HD23 ' A' ' 83' ' ' LEU . 19.4 mt -79.84 -39.07 31.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.731 0.3 . . . . 0.0 110.198 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.73 -36.39 82.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 178.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.899 HD12 ' HA ' ' A' ' 54' ' ' ASN . 10.2 mt -69.93 -39.23 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.94 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.733 ' O ' HD12 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -57.37 -45.87 83.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.128 179.407 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.55 HD12 HD12 ' A' ' 31' ' ' LEU . 64.0 mt -61.52 -51.1 76.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.127 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -58.98 -33.59 70.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.094 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -57.53 -49.42 76.39 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.885 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.733 HD12 ' O ' ' A' ' 58' ' ' SER . 1.1 mp -55.23 -51.58 66.14 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.108 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.457 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.35 -54.79 6.75 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.97 179.819 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.47 -25.18 67.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.641 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.439 ' O ' HG23 ' A' ' 69' ' ' THR . 50.8 mtmt -82.13 -29.49 31.63 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 121.105 0.478 . . . . 0.0 110.483 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.8 mm -70.84 -36.53 64.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.939 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.2 mmmm -94.85 1.23 55.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.93 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.454 ' O ' HG22 ' A' ' 69' ' ' THR . 10.1 m -134.12 21.25 3.76 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.454 HG22 ' O ' ' A' ' 68' ' ' SER . 1.4 p -160.22 -167.6 1.97 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.565 179.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.5 mtm -125.37 33.13 5.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.492 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.1 mtp -58.04 123.69 16.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.091 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.0 m -67.58 145.57 54.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.742 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -55.15 -30.82 60.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.652 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -59.0 -45.55 90.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.314 179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -33.95 72.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.094 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.592 ' CD1' HD23 ' A' ' 62' ' ' LEU . 18.3 mm -72.96 -33.95 44.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.425 179.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.22 -46.2 91.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.564 179.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -66.37 -48.54 69.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.467 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.552 ' O ' HD12 ' A' ' 83' ' ' LEU . 5.1 mt-10 -56.57 -33.99 66.7 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.861 ' O ' HG23 ' A' ' 84' ' ' VAL . 9.3 t80 -64.35 -36.52 84.39 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.71 -37.45 76.56 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.963 178.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.29 -34.07 73.24 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 121.203 0.525 . . . . 0.0 109.803 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.631 HD13 ' CD2' ' A' ' 27' ' ' LEU . 1.3 mt -76.78 -31.44 57.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.04 178.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.861 HG23 ' O ' ' A' ' 80' ' ' TYR . 56.7 t -68.59 -36.83 76.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.537 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.02 -49.15 39.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.564 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.76 -41.16 92.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.625 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.415 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 43.1 m -63.62 -50.35 69.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.574 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.58 -42.85 68.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.728 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -69.92 -27.05 64.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.81 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.508 HD23 HD23 ' A' ' 91' ' ' LEU . 5.5 tt -69.83 -49.11 55.73 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.017 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.565 HD21 ' CD1' ' A' ' 34' ' ' PHE . 7.2 mt -62.32 -50.9 69.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.123 0.487 . . . . 0.0 109.916 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.7 m -56.38 -34.2 66.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.725 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.18 -53.13 21.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.272 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.676 HD22 HG22 ' A' ' 38' ' ' VAL . 2.8 pp -68.63 -28.84 67.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.103 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.443 ' HB2' ' O ' ' A' ' 91' ' ' LEU . 10.0 tt0 -63.87 -54.13 39.68 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.864 0.364 . . . . 0.0 110.492 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -67.14 -29.52 69.25 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.58 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.922 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.445 ' O ' HG23 ' A' ' 24' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.903 0.382 . . . . 0.0 110.866 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.441 ' HG ' HG21 ' A' ' 66' ' ' ILE . 1.6 mp -58.57 -32.99 69.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.975 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.521 HG13 ' N ' ' A' ' 23' ' ' LYS . 9.8 p -60.51 -47.63 91.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.335 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.521 ' N ' HG13 ' A' ' 22' ' ' VAL . 12.5 mttm -59.81 -49.93 75.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.081 0.467 . . . . 0.0 110.349 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.657 HG12 HG23 ' A' ' 59' ' ' ILE . 10.7 t -56.85 -40.79 73.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.256 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -64.54 -37.57 94.59 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.479 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -56.86 -43.75 81.52 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.131 0.491 . . . . 0.0 109.897 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.87 HD12 HD11 ' A' ' 59' ' ' ILE . 0.2 OUTLIER -63.36 -40.15 96.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.732 178.909 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -53.82 -36.91 63.01 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.04 -42.63 84.48 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.675 178.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.55 -31.19 72.28 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.851 178.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.951 HD22 HD12 ' A' ' 59' ' ' ILE . 1.7 tp -63.58 -50.9 67.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.163 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.21 -34.44 72.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.176 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -45.27 94.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.312 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.882 ' O ' HG23 ' A' ' 38' ' ' VAL . 7.7 m-85 -60.38 -44.1 95.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.232 179.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -57.24 -37.28 72.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.58 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -61.17 -55.15 35.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.362 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 39.5 t -57.82 -37.61 61.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.368 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.882 HG23 ' O ' ' A' ' 34' ' ' PHE . 47.5 t -67.34 -43.7 87.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.853 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 m -55.81 -39.57 71.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.723 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.71 -27.74 68.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.031 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 44.2 mt -70.66 -40.27 73.11 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.999 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 63.61 14.16 7.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.41 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -138.42 158.45 44.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.688 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.769 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 58.7 30.53 65.88 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.27 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.612 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 1.6 mmtp -54.65 -52.08 73.12 Favored Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.612 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 11.0 Cg_endo -55.03 -49.28 17.13 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.447 2.098 . . . . 0.0 113.316 -179.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -59.66 -50.27 74.53 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.54 0.21 . . . . 0.0 111.436 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.769 HG23 ' O ' ' A' ' 44' ' ' GLY . 2.7 t -66.23 -55.39 19.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 120.841 0.353 . . . . 0.0 110.668 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.635 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 73.9 m-20 -52.7 -29.99 29.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.204 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -49.84 38.61 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.497 ' HB2' HD12 ' A' ' 90' ' ' LEU . 39.6 mt-30 -71.33 -45.96 61.73 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 179.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.749 ' CD1' HG12 ' A' ' 48' ' ' VAL . 3.6 mt -57.13 -30.4 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.461 178.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.893 ' CD ' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -69.12 -50.87 44.06 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 178.634 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.918 ' HA ' HD12 ' A' ' 57' ' ' ILE . 14.7 m-20 -51.29 -38.69 54.21 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.385 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 27.9 mt -70.92 -43.4 68.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.084 179.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.82 ' HG2' HD23 ' A' ' 31' ' ' LEU . 1.6 mm-40 -56.65 -36.91 70.06 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.918 HD12 ' HA ' ' A' ' 54' ' ' ASN . 10.2 mt -70.98 -41.75 76.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.188 178.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.889 ' O ' HD12 ' A' ' 62' ' ' LEU . 29.7 t -58.53 -52.1 67.07 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.519 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.951 HD12 HD22 ' A' ' 31' ' ' LEU . 36.8 mt -61.5 -52.64 58.73 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.661 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.422 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 1.4 t70 -56.55 -34.84 67.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.311 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.79 -49.22 78.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.852 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.889 HD12 ' O ' ' A' ' 58' ' ' SER . 1.3 mp -55.62 -56.56 18.87 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.041 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.428 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.73 -54.44 7.89 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.762 0.315 . . . . 0.0 110.841 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.12 -24.44 66.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.918 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.481 ' O ' HG23 ' A' ' 69' ' ' THR . 10.1 mtmt -82.2 -30.06 31.09 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.223 0.535 . . . . 0.0 110.57 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.648 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -72.29 -33.74 47.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.983 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.0 mmtt -89.53 -24.11 21.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.051 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.548 ' O ' HG22 ' A' ' 69' ' ' THR . 58.3 m -115.38 19.08 15.74 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.548 HG22 ' O ' ' A' ' 68' ' ' SER . 0.1 OUTLIER -163.08 166.46 23.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.588 179.196 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -107.3 43.72 1.15 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.567 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -53.71 142.18 24.17 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.174 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.4 m -79.22 148.97 32.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.774 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.77 -31.15 68.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.594 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -59.22 -45.39 91.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.443 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -34.33 75.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.421 179.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.675 ' CD1' HD23 ' A' ' 62' ' ' LEU . 23.3 mm -71.49 -33.96 51.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.72 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -63.88 -51.75 63.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.783 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -60.94 -47.09 88.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.743 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -56.44 -33.17 65.6 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.877 ' O ' HG23 ' A' ' 84' ' ' VAL . 4.6 t80 -64.32 -37.71 88.46 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -69.9 -37.67 76.05 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.15 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.32 -33.54 72.53 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 121.114 0.483 . . . . 0.0 109.873 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.691 HD12 ' HA ' ' A' ' 80' ' ' TYR . 4.7 mt -77.77 -30.96 51.7 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.05 178.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.877 HG23 ' O ' ' A' ' 80' ' ' TYR . 52.7 t -69.42 -38.19 76.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.746 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.408 ' O ' ' HG2' ' A' ' 88' ' ' GLU . 0.8 OUTLIER -72.34 -46.93 53.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.732 179.761 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 m -68.94 -36.6 78.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.941 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.509 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 58.9 m -69.94 -51.12 35.36 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.039 -179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 12.2 pt-20 -55.39 -42.95 74.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.947 0.403 . . . . 0.0 110.797 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.402 ' N ' ' HG3' ' A' ' 88' ' ' GLU . 37.8 t70 -71.31 -28.23 63.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.849 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.786 HD23 HD23 ' A' ' 91' ' ' LEU . 1.5 tt -68.22 -50.21 55.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.297 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.786 HD23 HD23 ' A' ' 90' ' ' LEU . 5.8 mt -63.76 -41.57 97.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.361 0.6 . . . . 0.0 109.715 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.7 m -56.55 -39.79 74.01 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.767 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.417 ' O ' ' HG3' ' A' ' 97' ' ' LYS . . . -66.83 -54.32 23.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.344 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.417 ' CD2' ' O ' ' A' ' 90' ' ' LEU . 0.3 OUTLIER -63.88 -25.93 68.38 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.798 179.83 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -40.03 77.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.96 0.409 . . . . 0.0 110.128 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.1 mtpt -64.14 -43.52 94.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.012 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.417 ' HG3' ' O ' ' A' ' 93' ' ' ALA . 12.9 mttm . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.952 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.7 t . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.689 0.28 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.689 ' HG ' HG21 ' A' ' 66' ' ' ILE . 0.7 OUTLIER -54.84 -32.91 61.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.206 -179.914 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.5 t -61.97 -52.57 58.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.173 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.69 -45.53 63.52 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.936 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.567 ' CG1' HG23 ' A' ' 59' ' ' ILE . 30.6 t -60.1 -48.53 87.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.719 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.76 -39.71 98.29 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.011 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.1 m -56.7 -42.15 78.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.022 0.439 . . . . 0.0 110.236 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.744 HD23 HD13 ' A' ' 83' ' ' LEU . 20.1 tp -64.71 -41.35 96.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.145 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.7 ttmm -52.81 -39.35 62.32 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -65.05 -42.37 94.32 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.423 178.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.36 -31.6 72.8 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.824 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.629 HD21 HG22 ' A' ' 52' ' ' ILE . 3.3 tt -61.97 -50.37 72.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.068 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -57.74 -38.83 76.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.164 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -57.89 -44.59 86.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.251 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.785 ' O ' HG23 ' A' ' 38' ' ' VAL . 23.5 m-85 -59.71 -43.19 94.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.394 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -56.48 -40.61 75.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.397 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.88 -52.07 66.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.278 179.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.2 t -59.76 -37.79 73.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.497 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.892 HG22 HD21 ' A' ' 94' ' ' LEU . 60.3 t -67.47 -43.86 87.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.802 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.8 m -61.95 -29.22 70.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.443 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.28 -31.43 71.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.845 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.599 ' O ' HD12 ' A' ' 41' ' ' LEU . 1.3 pp -113.84 79.1 1.21 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.026 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 43' ' ' ASP . 6.4 mmtp -46.55 99.23 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.91 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' A' ' 42' ' ' LYS . 33.9 t0 178.22 146.62 0.14 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.919 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.625 ' O ' HG12 ' A' ' 48' ' ' VAL . . . 50.79 42.2 45.42 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.706 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.58 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 7.8 mmtp -59.39 -51.62 80.06 Favored Pre-proline 0 C--N 1.329 -0.303 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.58 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 28.9 Cg_endo -63.78 -42.52 19.75 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.201 1.934 . . . . 0.0 112.943 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -65.15 -50.55 65.54 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.823 0.344 . . . . 0.0 111.193 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.625 HG12 ' O ' ' A' ' 44' ' ' GLY . 14.5 p -63.51 -55.23 24.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.598 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.592 ' HA ' HG13 ' A' ' 52' ' ' ILE . 60.3 m-20 -51.58 -31.2 23.8 Favored 'General case' 0 N--CA 1.461 0.116 0 CA-C-O 120.867 0.365 . . . . 0.0 110.702 179.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.09 -44.77 83.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.322 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -70.95 -48.7 51.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.269 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.698 ' HA ' HD12 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -57.46 -41.1 78.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.031 179.442 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.564 ' HD3' HD11 ' A' ' 57' ' ' ILE . 1.1 tttt -58.36 -52.43 65.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.684 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.899 ' HA ' HD12 ' A' ' 57' ' ' ILE . 11.0 m-20 -52.04 -39.81 60.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.944 0.402 . . . . 0.0 110.512 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.88 HD21 ' HB3' ' A' ' 86' ' ' SER . 10.5 mt -68.39 -44.44 75.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.594 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.65 -36.38 69.46 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.899 HD12 ' HA ' ' A' ' 54' ' ' ASN . 10.5 mt -71.35 -42.48 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.289 178.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.746 ' O ' HD12 ' A' ' 62' ' ' LEU . 2.8 m -60.4 -52.23 66.13 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.566 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.567 HG23 ' CG1' ' A' ' 24' ' ' VAL . 6.9 mt -58.13 -50.43 78.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.86 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -59.33 -37.16 77.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.813 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.66 -50.0 74.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.997 0.427 . . . . 0.0 110.676 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.746 HD12 ' O ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -55.72 -55.44 32.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.547 179.372 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.431 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -44.9 -54.61 6.27 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.263 -179.848 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.78 -25.93 66.9 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.678 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.55 ' HA ' HG23 ' A' ' 69' ' ' THR . 3.6 mtmp? -82.11 -29.49 31.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.024 0.44 . . . . 0.0 110.697 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.689 HG21 ' HG ' ' A' ' 21' ' ' LEU . 1.3 mm -73.12 -33.94 43.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.28 -179.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 14.3 mmtm -93.03 1.02 57.48 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.514 ' O ' HG22 ' A' ' 69' ' ' THR . 17.0 m -147.23 21.76 1.21 Allowed 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.55 HG23 ' HA ' ' A' ' 65' ' ' LYS . 0.2 OUTLIER -161.85 158.6 25.75 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.752 179.362 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -97.39 43.52 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.318 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.4 129.13 21.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.341 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.427 HG22 ' H ' ' A' ' 74' ' ' GLU . 12.4 m -71.36 137.83 48.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.578 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.84 -30.29 22.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.717 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.427 ' H ' HG22 ' A' ' 72' ' ' THR . 1.1 tt0 -59.34 -43.92 92.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.377 179.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 15.1 tp60 -68.05 -33.97 75.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.417 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.655 ' CD1' HD23 ' A' ' 62' ' ' LEU . 22.8 mm -69.58 -39.46 78.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.498 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -41.35 96.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.669 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.25 -48.24 68.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.453 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -56.57 -34.25 66.96 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.858 ' O ' HG23 ' A' ' 84' ' ' VAL . 52.5 t80 -65.04 -36.81 85.55 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.407 -0.961 . . . . 0.0 108.407 177.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -69.84 -37.62 76.24 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.775 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.94 -33.61 72.13 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.744 HD13 HD23 ' A' ' 27' ' ' LEU . 2.0 mt -76.88 -32.39 57.44 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.105 179.007 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.858 HG23 ' O ' ' A' ' 80' ' ' TYR . 43.2 t -69.52 -36.66 72.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.495 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.404 ' O ' ' HG3' ' A' ' 88' ' ' GLU . 4.4 mmtm -72.13 -42.66 65.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.566 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.88 ' HB3' HD21 ' A' ' 55' ' ' LEU . 0.3 OUTLIER -73.91 -35.65 64.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.492 179.587 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.431 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 34.8 m -68.59 -50.61 50.32 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.645 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 85' ' ' LYS . 1.6 pp20? -60.19 -38.7 84.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.323 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -65.85 -32.86 74.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.235 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.535 HD23 ' C ' ' A' ' 90' ' ' LEU . 5.7 tt -64.66 -44.07 91.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.667 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.0 mt -62.09 -43.54 98.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.789 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 57.9 m -54.66 -46.68 74.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.449 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.3 -40.71 97.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.415 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.892 HD21 HG22 ' A' ' 38' ' ' VAL . 1.3 mp -57.72 -49.75 75.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.56 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.83 -42.33 75.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.592 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.13 -38.6 80.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.571 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.405 ' CD ' ' HA ' ' A' ' 94' ' ' LEU . 7.2 mttt . . . . . 0 C--N 1.33 -0.261 0 CA-C-O 121.371 0.605 . . . . 0.0 111.069 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.2 p . . . . . 0 C--O 1.23 0.047 0 CA-C-O 120.872 0.368 . . . . 0.0 110.829 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.5 ' HG ' HG21 ' A' ' 66' ' ' ILE . 13.6 mt -54.6 -32.76 59.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.95 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.504 HG13 ' N ' ' A' ' 23' ' ' LYS . 9.9 p -59.13 -47.06 91.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.022 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.504 ' N ' HG13 ' A' ' 22' ' ' VAL . 5.6 tttt -61.54 -41.98 98.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.077 0.465 . . . . 0.0 110.3 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.564 ' CG1' HG23 ' A' ' 59' ' ' ILE . 40.8 t -57.03 -44.88 83.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.49 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.17 -37.69 94.92 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.711 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.44 -44.57 84.82 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.895 0.378 . . . . 0.0 110.222 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.679 HD23 HD13 ' A' ' 83' ' ' LEU . 20.0 tp -62.65 -41.79 99.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.088 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.3 tptt -53.28 -38.5 63.15 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.9 mptt -65.15 -40.67 94.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.32 178.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.453 ' HD3' HD12 ' A' ' 27' ' ' LEU . 60.8 mtp180 -63.44 -31.32 72.45 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.739 178.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.518 HD13 ' CD1' ' A' ' 59' ' ' ILE . 0.2 OUTLIER -63.09 -49.09 75.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.103 179.143 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -59.48 -37.0 77.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.315 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -50.24 73.56 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.332 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.89 ' O ' HG23 ' A' ' 38' ' ' VAL . 4.1 m-85 -58.78 -45.51 89.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.619 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -51.56 -43.8 62.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.02 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -61.43 -53.92 50.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.566 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 33.5 t -58.63 -37.7 66.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.767 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 1.116 HG22 HD21 ' A' ' 94' ' ' LEU . 39.3 t -71.08 -40.46 75.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.081 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.44 -38.39 77.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.86 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.32 -20.05 63.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.436 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.85 HD12 ' HA ' ' A' ' 38' ' ' VAL . 44.4 mt -75.33 -42.48 54.29 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.211 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.61 14.0 7.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.439 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -131.68 146.53 52.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.704 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.712 ' O ' HG12 ' A' ' 48' ' ' VAL . . . 57.22 27.93 58.22 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.334 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.799 ' HE3' HG12 ' A' ' 38' ' ' VAL . 0.6 OUTLIER -61.92 -49.33 86.08 Favored Pre-proline 0 C--N 1.329 -0.313 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.716 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.633 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 10.8 Cg_endo -55.0 -45.48 40.59 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.146 1.897 . . . . 0.0 112.954 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 50' ' ' ARG . 11.8 pt-20 -70.06 -50.73 38.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.768 0.318 . . . . 0.0 111.479 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.712 HG12 ' O ' ' A' ' 44' ' ' GLY . 8.3 p -62.04 -55.29 25.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.718 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.572 ' HA ' HG13 ' A' ' 52' ' ' ILE . 98.2 m-20 -51.59 -43.79 62.58 Favored 'General case' 0 N--CA 1.463 0.204 0 O-C-N 123.078 0.236 . . . . 0.0 111.399 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.514 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -60.78 -36.04 77.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.773 0.32 . . . . 0.0 110.682 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.514 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 44.6 mt-30 -74.42 -48.57 26.87 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.219 0.533 . . . . 0.0 109.973 179.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.861 ' HA ' HD12 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -57.56 -38.86 66.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.923 179.319 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.411 ' O ' HG13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -61.45 -53.2 59.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.597 179.507 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.922 ' HA ' HD12 ' A' ' 57' ' ' ILE . 17.6 m-20 -51.54 -36.52 45.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.786 0.327 . . . . 0.0 110.724 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.861 HD12 ' HA ' ' A' ' 52' ' ' ILE . 2.7 mt -72.93 -45.54 57.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.82 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.772 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.4 OUTLIER -56.74 -33.11 66.23 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.779 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.922 HD12 ' HA ' ' A' ' 54' ' ' ASN . 14.5 mt -71.26 -44.19 73.51 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.188 178.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.721 ' O ' HD12 ' A' ' 62' ' ' LEU . 8.1 m -59.11 -46.67 87.71 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.377 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.772 HD12 ' HA ' ' A' ' 56' ' ' GLU . 5.7 mt -58.46 -55.07 24.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.732 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -57.9 -33.73 69.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.543 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.84 -49.97 74.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.206 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.721 HD12 ' O ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -55.89 -54.64 42.14 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.264 179.045 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.426 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.03 -54.95 6.04 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.255 179.914 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.27 -25.17 66.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.649 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 24.1 mtpt -82.29 -29.97 30.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.166 0.508 . . . . 0.0 110.62 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -71.99 -34.06 49.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.092 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.64 1.16 55.56 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.238 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.45 ' O ' HG22 ' A' ' 69' ' ' THR . 58.3 m -138.87 21.91 2.65 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.45 HG22 ' O ' ' A' ' 68' ' ' SER . 1.3 p -160.16 179.61 8.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.869 0.366 . . . . 0.0 110.73 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.58 37.36 3.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.565 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 16.7 mmm -56.0 146.18 23.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.125 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.2 m -84.97 142.41 29.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.755 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.99 -29.81 57.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.707 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -46.39 89.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.451 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.46 -34.23 75.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.436 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.639 ' CD1' HD23 ' A' ' 62' ' ' LEU . 27.0 mm -70.58 -33.87 55.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.77 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 8.4 tp60 -66.46 -42.65 87.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.872 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.59 -50.9 56.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.72 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -56.37 -34.09 66.33 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.916 ' O ' HG23 ' A' ' 84' ' ' VAL . 64.9 t80 -64.55 -35.65 81.66 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -69.55 -37.52 77.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.963 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.25 -37.27 77.15 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.313 0.578 . . . . 0.0 109.589 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.679 HD13 HD23 ' A' ' 27' ' ' LEU . 26.3 mt -75.51 -30.71 59.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.101 178.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.916 HG23 ' O ' ' A' ' 80' ' ' TYR . 61.7 t -69.17 -34.57 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.53 179.347 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.16 -49.11 38.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.464 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 m -68.1 -36.85 80.45 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.568 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.0 t -66.64 -50.33 63.3 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.811 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.4 ' HG3' ' N ' ' A' ' 89' ' ' ASP . 8.7 pt-20 -58.79 -36.0 73.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.487 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.4 ' N ' ' HG3' ' A' ' 88' ' ' GLU . 0.8 OUTLIER -70.19 -31.42 68.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.73 179.649 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.414 HD23 HD23 ' A' ' 91' ' ' LEU . 6.5 tt -66.34 -49.05 68.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.993 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.678 HD21 ' CE1' ' A' ' 34' ' ' PHE . 7.0 mt -60.71 -49.09 78.89 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.143 0.497 . . . . 0.0 109.848 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.2 m -55.73 -42.72 75.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.662 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.77 -52.25 63.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.685 179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 1.116 HD21 HG22 ' A' ' 38' ' ' VAL . 4.6 mp -57.45 -42.68 82.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.756 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -55.59 -43.88 76.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.611 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.7 mtmt -66.35 -29.64 69.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.031 0.443 . . . . 0.0 109.835 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.6 mttt . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.458 -179.96 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.4 p . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.769 0.319 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.455 HD23 ' HA ' ' A' ' 63' ' ' MET . 2.9 mt -54.69 -32.89 60.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.161 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.501 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.0 p -63.98 -46.5 93.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.412 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.501 ' N ' HG13 ' A' ' 22' ' ' VAL . 47.8 mttm -56.73 -50.52 71.96 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.019 0.438 . . . . 0.0 110.674 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 1.034 HG12 HG23 ' A' ' 59' ' ' ILE . 3.5 t -57.04 -39.96 69.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.116 179.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.1 -37.15 93.81 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.595 179.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.1 m -57.02 -47.28 81.28 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.078 0.466 . . . . 0.0 110.084 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.497 HD11 ' HB2' ' A' ' 83' ' ' LEU . 4.1 tt -61.53 -38.7 88.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.818 179.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.463 ' HB2' HG21 ' A' ' 59' ' ' ILE . 6.5 tttt -54.92 -37.8 66.84 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 178.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.0 -41.85 95.0 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.33 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.26 -30.48 71.62 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.795 178.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.555 HD13 ' CD1' ' A' ' 59' ' ' ILE . 0.3 OUTLIER -63.0 -52.35 63.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.101 179.312 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -57.93 -36.06 71.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.076 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.417 ' O ' HG23 ' A' ' 37' ' ' VAL . 0.1 OUTLIER -58.99 -44.55 91.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.244 179.305 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.857 ' O ' HG23 ' A' ' 38' ' ' VAL . 13.1 m-85 -61.18 -43.37 98.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.346 179.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.8 m-20 -54.09 -44.67 71.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.534 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -59.26 -54.32 48.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.062 0.458 . . . . 0.0 110.439 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 33' ' ' LYS . 22.4 t -55.89 -37.78 49.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.49 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.857 HG23 ' O ' ' A' ' 34' ' ' PHE . 48.8 t -69.58 -40.86 80.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.618 179.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.8 t -63.72 -23.29 67.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.334 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.05 -38.75 92.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.564 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.605 HD21 ' HA ' ' A' ' 38' ' ' VAL . 0.5 OUTLIER -88.81 -34.23 17.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.682 0.277 . . . . 0.0 111.23 -179.836 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.86 10.02 6.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.756 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.432 ' H ' HD12 ' A' ' 41' ' ' LEU . 5.1 t0 -103.76 103.28 13.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.78 0.324 . . . . 0.0 111.071 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.715 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 101.11 53.67 1.0 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.575 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.52 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 2.2 mmtt -66.69 -57.27 12.28 Favored Pre-proline 0 C--N 1.327 -0.388 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 13.8 Cg_endo -56.88 -49.47 14.39 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.47 2.113 . . . . 0.0 112.974 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.27 -50.14 72.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.826 0.346 . . . . 0.0 111.213 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.765 HG11 HG11 ' A' ' 38' ' ' VAL . 50.7 t -64.59 -55.57 20.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.706 179.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.446 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 85.3 m-20 -55.46 -25.57 37.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.092 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.32 -49.44 34.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.861 0.362 . . . . 0.0 111.585 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -76.62 -44.56 33.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.492 0.663 . . . . 0.0 109.753 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.767 ' HA ' HD12 ' A' ' 55' ' ' LEU . 1.8 mt -57.62 -35.34 50.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.337 179.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.504 ' HG3' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -69.4 -51.71 33.91 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.591 179.283 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.94 ' HA ' HD12 ' A' ' 57' ' ' ILE . 16.4 m-20 -50.99 -34.46 29.2 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.712 0.291 . . . . 0.0 110.513 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.767 HD12 ' HA ' ' A' ' 52' ' ' ILE . 1.7 mt -75.81 -43.49 45.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.315 179.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.832 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -56.86 -36.41 70.01 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.551 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.94 HD12 ' HA ' ' A' ' 54' ' ' ASN . 12.2 mt -68.51 -40.73 82.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 114.937 -1.028 . . . . 0.0 109.946 178.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.74 ' O ' HD12 ' A' ' 62' ' ' LEU . 9.8 m -57.48 -45.62 84.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.482 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 1.034 HG23 HG12 ' A' ' 24' ' ' VAL . 4.6 mt -60.23 -50.72 79.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.398 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.436 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 72.7 m-20 -57.08 -31.68 65.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.166 179.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -63.25 -49.32 74.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.672 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.74 HD12 ' O ' ' A' ' 58' ' ' SER . 1.6 mp -56.16 -56.99 14.17 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.023 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.455 ' HA ' HD23 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -46.44 -50.72 16.4 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.7 0.286 . . . . 0.0 110.841 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.07 -24.44 67.7 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.753 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.9 mtpt -82.45 -29.36 30.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.113 0.482 . . . . 0.0 110.557 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.654 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -73.07 -37.13 52.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.201 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 5.5 mmmt -93.96 -27.46 16.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.542 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.767 ' O ' HG23 ' A' ' 69' ' ' THR . 1.2 t -105.67 24.96 11.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.699 0.285 . . . . 0.0 111.411 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.767 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 174.66 155.06 0.14 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.887 179.746 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 5.9 mtm -107.73 69.27 0.73 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.907 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.64 ' SD ' HD11 ' A' ' 76' ' ' ILE . 9.2 ptm -72.11 173.29 8.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.791 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.43 141.96 28.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.066 -179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.08 -29.89 67.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.714 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -58.01 -40.25 80.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.725 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -35.04 79.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.52 179.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.663 ' CD1' HD23 ' A' ' 62' ' ' LEU . 27.0 mm -67.96 -37.54 78.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.833 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 4.0 tp60 -66.68 -52.12 48.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.853 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -45.67 85.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.731 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -56.56 -35.13 67.81 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.912 ' O ' HG23 ' A' ' 84' ' ' VAL . 11.2 t80 -64.21 -38.08 89.76 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 177.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -69.97 -35.79 74.72 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.09 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.42 79.2 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.242 0.544 . . . . 0.0 109.75 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.497 ' HB2' HD11 ' A' ' 27' ' ' LEU . 6.5 mt -74.45 -31.25 62.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.045 178.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.912 HG23 ' O ' ' A' ' 80' ' ' TYR . 61.4 t -69.57 -38.99 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.356 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -66.13 -49.14 68.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.377 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 74.7 m -68.27 -38.06 81.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.407 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.437 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 24.3 m -65.7 -50.37 65.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.692 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.89 -43.58 73.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.985 0.421 . . . . 0.0 110.728 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -67.56 -29.12 68.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.707 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.494 HD23 HD23 ' A' ' 91' ' ' LEU . 6.1 tt -67.92 -48.89 64.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.064 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.617 HD21 ' CD1' ' A' ' 34' ' ' PHE . 7.0 mt -61.03 -52.44 64.94 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.057 0.456 . . . . 0.0 110.076 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.4 m -58.58 -38.32 77.66 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.662 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.25 -36.06 76.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.875 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.511 HD21 HG13 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -70.23 -42.42 72.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.856 179.904 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.01 -54.25 49.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.686 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.6 mtpp -63.78 -28.9 70.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.37 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.5 tttp . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.161 -179.968 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.583 ' OG ' HG21 ' A' ' 76' ' ' ILE . 40.2 t . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.831 0.348 . . . . 0.0 110.799 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.5 -32.73 72.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.933 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.517 HG13 ' N ' ' A' ' 23' ' ' LYS . 11.5 p -61.18 -47.98 91.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.254 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.517 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -59.45 -37.91 79.36 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.912 0.387 . . . . 0.0 110.589 179.666 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 20' ' ' SER . 19.8 t -58.67 -50.61 78.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.395 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.15 -40.45 97.23 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.644 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.644 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -57.02 -37.99 72.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.08 0.466 . . . . 0.0 110.022 179.292 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.818 HD22 HD13 ' A' ' 83' ' ' LEU . 0.7 OUTLIER -64.97 -42.83 94.23 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 178.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.75 -35.78 56.74 Favored 'General case' 0 C--N 1.333 -0.128 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.644 ' HG3' ' HA ' ' A' ' 26' ' ' THR . 23.2 mttt -61.69 -45.64 93.1 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.592 178.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -36.96 71.55 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.316 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.402 HD23 ' HB3' ' A' ' 56' ' ' GLU . 6.1 mp -61.36 -51.2 69.8 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.491 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -57.94 -37.04 73.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.296 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.434 ' O ' HG23 ' A' ' 37' ' ' VAL . 3.8 tptt -58.86 -43.2 90.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.263 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.814 ' O ' HG23 ' A' ' 38' ' ' VAL . 13.0 m-85 -63.91 -41.39 97.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.612 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 45.5 m-20 -55.19 -44.19 75.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.872 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -62.72 -54.29 41.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.766 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 33' ' ' LYS . 33.7 t -57.71 -38.22 63.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.06 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.891 HG21 HG11 ' A' ' 48' ' ' VAL . 47.9 t -75.07 -35.45 34.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.885 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.4 p -60.78 -34.02 73.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.531 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.11 -21.42 59.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.269 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' A' ' 38' ' ' VAL . 77.5 mt -71.45 -41.28 69.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.93 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.67 13.81 7.66 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.567 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -131.06 135.56 47.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.92 0.391 . . . . 0.0 110.898 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.549 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 59.05 57.27 20.73 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.488 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.498 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 3.7 mmmm -77.45 -45.09 2.62 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 120.508 0.194 . . . . 0.0 111.348 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.498 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 50.2 Cg_exo -53.68 -42.36 66.75 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.256 1.971 . . . . 0.0 112.475 -179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -60.64 -50.23 74.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.921 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.891 HG11 HG21 ' A' ' 38' ' ' VAL . 5.1 t -65.92 -55.21 20.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.082 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.6 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 97.4 m-20 -52.85 -31.11 37.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.362 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 26.4 ttm180 -73.06 -47.89 40.74 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -73.01 -41.27 64.44 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.621 0.724 . . . . 0.0 109.41 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.618 HG13 HG12 ' A' ' 48' ' ' VAL . 1.4 mt -61.87 -31.54 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.082 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.6 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -70.16 -55.05 10.35 Favored 'General case' 0 N--CA 1.46 0.055 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.366 179.54 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.961 ' HA ' HD12 ' A' ' 57' ' ' ILE . 28.5 p30 -59.83 -25.42 64.98 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.989 -179.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 71.9 mt -77.54 -46.74 21.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.514 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.541 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -57.0 -32.88 66.57 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.957 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.961 HD12 ' HA ' ' A' ' 54' ' ' ASN . 13.6 mt -71.4 -41.43 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.063 178.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.558 ' O ' HD12 ' A' ' 62' ' ' LEU . 69.1 m -57.46 -47.6 81.42 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.214 179.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.541 HD12 ' HA ' ' A' ' 56' ' ' GLU . 11.7 mt -59.78 -49.83 82.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.271 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.79 -32.58 71.92 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.114 179.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -57.83 -49.86 75.22 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.96 179.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.642 ' O ' HG12 ' A' ' 66' ' ' ILE . 0.8 OUTLIER -55.72 -53.62 54.41 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.2 178.89 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.432 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.28 -56.44 4.87 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.018 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.62 -24.07 65.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.607 179.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.07 -29.19 31.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.233 0.539 . . . . 0.0 110.415 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.642 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.8 mm -73.46 -41.11 56.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.499 -179.302 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.75 -29.51 16.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.875 -179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.765 ' O ' HG23 ' A' ' 69' ' ' THR . 0.8 OUTLIER -102.32 24.23 10.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.693 0.282 . . . . 0.0 111.713 -179.387 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.765 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 177.57 149.82 0.18 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.935 179.523 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.4 mtm -76.06 63.22 1.77 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.957 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.51 125.77 25.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.788 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.1 m -78.11 135.54 37.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.799 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.86 -33.71 50.98 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.871 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.39 -47.51 83.64 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.347 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.15 -32.92 74.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.353 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.629 ' CD1' HD23 ' A' ' 62' ' ' LEU . 26.1 mm -71.58 -38.69 68.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.695 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -52.18 66.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.634 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.58 -47.04 80.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.485 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -56.54 -34.06 66.71 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.907 ' O ' HG23 ' A' ' 84' ' ' VAL . 16.2 t80 -64.24 -37.26 86.86 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -69.67 -36.7 76.26 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.978 178.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.49 -36.07 75.34 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.146 0.498 . . . . 0.0 109.688 179.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.818 HD13 HD22 ' A' ' 27' ' ' LEU . 5.2 mt -76.74 -31.25 56.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.004 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.907 HG23 ' O ' ' A' ' 80' ' ' TYR . 54.0 t -69.55 -34.83 63.49 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.466 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.8 tptp -71.99 -49.26 38.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.408 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 11.6 m -66.71 -43.7 83.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.406 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 98.5 p -61.51 -48.46 80.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.505 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -55.28 -41.04 71.73 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.702 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.98 -34.36 78.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.602 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 tt -63.36 -46.3 87.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.791 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.765 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.3 mt -63.75 -47.47 80.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.129 0.49 . . . . 0.0 109.825 179.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 33.8 p -56.52 -39.51 73.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.564 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.99 -47.03 75.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.592 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 85.7 mt -57.2 -44.78 83.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.632 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -39.85 86.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.368 179.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.4 mttt -64.22 -29.15 70.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.853 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.227 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.309 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 120.84 0.352 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.471 ' HG ' HG21 ' A' ' 66' ' ' ILE . 20.4 mt -54.01 -33.0 55.96 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.074 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.501 HG13 ' N ' ' A' ' 23' ' ' LYS . 12.3 p -60.78 -45.91 97.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.042 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.501 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -60.44 -46.81 88.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.058 0.456 . . . . 0.0 110.587 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.535 HG13 HG23 ' A' ' 59' ' ' ILE . 19.4 t -56.97 -44.78 83.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.419 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.89 -36.41 92.78 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.707 -0.759 . . . . 0.0 111.68 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.3 m -57.98 -47.51 82.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.913 0.387 . . . . 0.0 110.186 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.768 HD13 HD13 ' A' ' 83' ' ' LEU . 12.8 mt -60.84 -39.04 87.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.078 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.483 ' HA ' HD12 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -54.55 -40.62 68.88 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.589 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.57 -37.23 86.84 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.387 178.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.405 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -62.04 -33.4 74.3 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.726 178.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 1.006 HD11 HD12 ' A' ' 59' ' ' ILE . 64.4 mt -65.26 -48.86 71.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.022 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -57.75 -42.06 83.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.195 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.4 tptt -61.08 -41.93 97.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.047 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.829 ' CZ ' HD21 ' A' ' 91' ' ' LEU . 4.0 m-30 -60.73 -45.44 94.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.366 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 12.6 m-20 -58.65 -36.45 74.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.615 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -61.42 -55.29 32.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.479 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 36.6 t -58.97 -37.93 70.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.67 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.87 HG21 HG11 ' A' ' 48' ' ' VAL . 46.3 t -70.82 -37.79 70.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.871 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.56 -36.88 79.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.426 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.34 -12.77 60.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.387 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.532 HD12 ' HA ' ' A' ' 38' ' ' VAL . 52.3 mt -85.98 -55.52 3.91 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.965 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.13 3.73 4.44 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.649 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -114.09 126.64 55.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.781 0.324 . . . . 0.0 110.692 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.772 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 75.89 31.93 54.59 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.326 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.535 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 6.8 mmtt -48.1 -57.31 10.72 Favored Pre-proline 0 C--N 1.331 -0.236 0 N-CA-C 111.606 0.224 . . . . 0.0 111.606 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 10.6 Cg_endo -54.1 -49.19 17.9 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.524 2.149 . . . . 0.0 112.513 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -53.34 -49.71 66.55 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.017 0.437 . . . . 0.0 111.264 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.87 HG11 HG21 ' A' ' 38' ' ' VAL . 2.5 t -67.64 -55.23 17.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.92 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.567 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 79.5 m-20 -52.66 -35.7 55.48 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.494 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 11.6 ptt85 -73.65 -38.96 64.82 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.494 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 61.7 mt-30 -75.94 -47.75 23.95 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.731 0.777 . . . . 0.0 109.163 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.727 ' CD1' HG12 ' A' ' 48' ' ' VAL . 3.6 mt -57.03 -32.14 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 114.555 -1.202 . . . . 0.0 110.09 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.613 ' HD2' HD11 ' A' ' 57' ' ' ILE . 0.4 OUTLIER -69.13 -52.99 22.54 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.418 179.011 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.919 ' HA ' HD12 ' A' ' 57' ' ' ILE . 13.1 m-20 -50.99 -34.31 28.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.875 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 51' ' ' GLN . 26.4 mt -76.0 -45.96 31.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.96 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.451 ' HG3' ' N ' ' A' ' 57' ' ' ILE . 0.4 OUTLIER -56.65 -31.91 64.83 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.915 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.919 HD12 ' HA ' ' A' ' 54' ' ' ASN . 16.8 mt -71.34 -44.79 72.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.055 178.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.603 ' O ' HD12 ' A' ' 62' ' ' LEU . 4.6 m -60.27 -52.41 65.39 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.355 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 1.006 HD12 HD11 ' A' ' 31' ' ' LEU . 71.6 mt -58.24 -51.43 71.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.585 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.16 -33.52 71.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.206 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -57.64 -49.49 76.28 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.962 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.657 ' O ' HG12 ' A' ' 66' ' ' ILE . 0.8 OUTLIER -55.33 -52.51 63.24 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.16 178.912 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.502 ' HE3' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -44.96 -58.55 3.08 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.02 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.24 -24.2 62.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.576 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.434 ' HA ' HG23 ' A' ' 69' ' ' THR . 0.2 OUTLIER -82.18 -29.66 31.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.141 0.496 . . . . 0.0 110.562 179.485 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.2 mm -70.49 -40.45 77.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.237 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.27 1.23 51.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.17 -179.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.478 ' O ' HG22 ' A' ' 69' ' ' THR . 1.5 m -132.95 21.18 4.13 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 120.748 -0.381 . . . . 0.0 112.018 -179.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.478 HG22 ' O ' ' A' ' 68' ' ' SER . 1.0 OUTLIER -160.34 -175.34 4.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.858 0.361 . . . . 0.0 110.833 179.32 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -126.55 33.42 4.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.392 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.1 mmm -56.91 149.98 17.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.999 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.7 m -80.67 143.94 32.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.904 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.81 -30.77 58.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.64 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -58.08 -46.26 85.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.39 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.06 -35.68 73.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.203 179.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.646 HG22 ' CE2' ' A' ' 80' ' ' TYR . 18.4 mm -69.54 -33.97 59.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.489 179.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 80' ' ' TYR . 8.0 tp-100 -61.83 -49.44 76.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.468 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 mmtt -62.59 -41.61 99.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.273 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -57.69 -36.22 71.67 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.905 ' O ' HG23 ' A' ' 84' ' ' VAL . 14.5 m-85 -64.32 -35.9 82.38 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 177.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -69.44 -37.58 77.43 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.026 178.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.46 -34.62 75.76 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.24 0.543 . . . . 0.0 109.61 178.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.768 HD13 HD13 ' A' ' 27' ' ' LEU . 54.4 mt -76.87 -30.26 56.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.06 178.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.905 HG23 ' O ' ' A' ' 80' ' ' TYR . 66.4 t -68.12 -35.76 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.41 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.7 tptt -72.44 -49.26 34.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.599 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.9 m -66.03 -43.11 88.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.518 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 96.3 p -62.38 -46.7 87.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.525 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -55.94 -41.26 74.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.634 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.96 -32.12 73.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.704 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.589 HD22 ' CD2' ' A' ' 34' ' ' PHE . 7.9 tt -63.97 -47.8 78.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.046 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.829 HD21 ' CZ ' ' A' ' 34' ' ' PHE . 7.6 mt -60.59 -52.55 64.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.109 0.481 . . . . 0.0 109.925 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 69.8 m -54.93 -38.63 67.91 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.487 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.435 ' HA ' ' HG2' ' A' ' 96' ' ' LYS . . . -68.93 -36.17 77.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.621 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.9 tp -66.29 -49.06 68.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.745 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -55.92 -48.92 74.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.613 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.435 ' HG2' ' HA ' ' A' ' 93' ' ' ALA . 9.0 pttt -62.84 -28.62 70.14 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.167 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.599 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.553 ' HB3' HG21 ' A' ' 76' ' ' ILE . 1.0 OUTLIER . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.738 0.304 . . . . 0.0 111.025 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.778 ' HG ' HG21 ' A' ' 66' ' ' ILE . 5.0 mt -53.78 -32.84 53.97 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.061 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.49 HG13 ' N ' ' A' ' 23' ' ' LYS . 11.6 p -67.8 -45.15 84.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.97 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.49 ' N ' HG13 ' A' ' 22' ' ' VAL . 2.0 tppp? -63.43 -52.98 59.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.928 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.757 HG12 HG23 ' A' ' 59' ' ' ILE . 23.7 t -56.76 -46.97 83.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.578 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -58.83 -40.22 94.84 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.511 -0.852 . . . . 0.0 111.419 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.469 HG22 ' HE ' ' A' ' 30' ' ' ARG . 48.4 m -57.18 -38.96 74.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.063 0.459 . . . . 0.0 109.925 179.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.702 ' CD2' HD13 ' A' ' 83' ' ' LEU . 15.8 tp -62.84 -44.06 97.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.878 179.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.95 -39.6 63.03 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -36.2 83.55 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.582 178.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.469 ' HE ' HG22 ' A' ' 26' ' ' THR . 0.0 OUTLIER -65.62 -33.61 76.3 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.876 179.024 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.726 HD13 ' CD1' ' A' ' 59' ' ' ILE . 0.7 OUTLIER -64.96 -42.02 94.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.945 179.194 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.28 -49.39 77.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.832 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.5 ' O ' HG23 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -57.86 -35.78 71.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.823 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.829 ' O ' HG23 ' A' ' 38' ' ' VAL . 15.7 m-85 -65.62 -39.87 91.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.891 0.376 . . . . 0.0 110.411 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -61.33 -40.61 94.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.379 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -53.66 54.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.363 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 33' ' ' LYS . 22.6 t -57.54 -37.96 61.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.723 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.829 HG23 ' O ' ' A' ' 34' ' ' PHE . 77.2 t -71.18 -39.41 73.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.892 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.84 -37.16 75.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.74 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.76 -17.98 65.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.426 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.63 HD12 ' HA ' ' A' ' 38' ' ' VAL . 24.4 mt -79.93 -34.64 38.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.148 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER 64.77 12.69 7.87 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.476 -179.741 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -133.82 155.28 50.11 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.814 0.34 . . . . 0.0 110.766 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.854 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 57.8 27.79 59.6 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.32 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.524 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 1.1 mmtt -55.73 -57.21 22.69 Favored Pre-proline 0 C--N 1.329 -0.306 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 11.7 Cg_endo -55.69 -49.09 16.96 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.428 2.085 . . . . 0.0 112.68 -179.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 4.2 mt-10 -55.49 -48.95 73.78 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.069 0.461 . . . . 0.0 111.074 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.854 HG23 ' O ' ' A' ' 44' ' ' GLY . 18.8 t -67.19 -50.06 66.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.256 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.416 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 86.0 m-20 -59.06 -33.09 70.38 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.493 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 8.1 ptp180 -73.51 -40.21 64.21 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.442 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.493 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 31.7 mt-30 -75.98 -49.77 16.74 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.05 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.591 HG13 ' O ' ' A' ' 48' ' ' VAL . 2.0 mt -56.89 -29.91 32.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.005 178.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.473 ' HA ' ' HG2' ' A' ' 56' ' ' GLU . 32.2 tttt -69.26 -53.17 21.16 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.159 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.933 ' HA ' HD12 ' A' ' 57' ' ' ILE . 8.4 m-20 -53.17 -32.39 47.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.843 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.563 ' HB2' HD21 ' A' ' 31' ' ' LEU . 55.6 mt -74.51 -47.82 30.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.305 -179.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.473 ' HG2' ' HA ' ' A' ' 53' ' ' LYS . 3.5 pt-20 -56.21 -31.79 63.8 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.933 HD12 ' HA ' ' A' ' 54' ' ' ASN . 15.6 mt -71.04 -43.26 76.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.897 178.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.825 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.5 m -58.48 -46.96 85.57 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.255 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.757 HG23 HG12 ' A' ' 24' ' ' VAL . 55.5 mt -60.08 -55.56 23.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.458 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.2 -34.12 68.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.245 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -56.8 -49.17 76.14 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.197 0.522 . . . . 0.0 109.899 179.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.825 HD12 ' O ' ' A' ' 58' ' ' SER . 1.2 mp -55.09 -48.77 73.1 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.867 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.409 ' CE ' ' HB ' ' A' ' 24' ' ' VAL . 12.5 mmt -44.85 -59.84 2.34 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.764 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.94 -23.58 61.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.589 179.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.405 ' O ' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -82.03 -29.0 32.19 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.293 0.568 . . . . 0.0 110.538 179.37 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.778 HG21 ' HG ' ' A' ' 21' ' ' LEU . 2.3 mm -73.41 -45.7 51.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.913 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.3 -32.43 17.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.013 -178.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.806 ' O ' HG23 ' A' ' 69' ' ' THR . 0.3 OUTLIER -98.08 22.18 9.78 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.233 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.806 HG23 ' O ' ' A' ' 68' ' ' SER . 0.6 OUTLIER 179.36 149.75 0.29 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.817 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -78.9 61.2 3.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.951 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.07 120.59 10.57 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.806 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.2 m -65.32 132.71 49.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.774 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.34 -31.51 54.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.83 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -61.33 -45.75 93.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.437 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.42 -33.72 75.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.424 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.625 ' CD1' HD23 ' A' ' 62' ' ' LEU . 20.9 mm -68.53 -33.88 62.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.787 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -67.8 -48.69 65.58 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.856 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -49.02 70.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.578 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -56.61 -33.54 66.35 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 178.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.824 ' O ' HG23 ' A' ' 84' ' ' VAL . 54.8 t80 -64.89 -35.62 81.73 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 177.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -69.54 -37.05 76.92 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.93 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.5 -35.38 75.8 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 121.28 0.562 . . . . 0.0 109.633 178.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.702 HD13 ' CD2' ' A' ' 27' ' ' LEU . 7.1 mt -75.51 -31.57 60.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.082 178.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.824 HG23 ' O ' ' A' ' 80' ' ' TYR . 75.6 t -67.71 -34.64 69.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.386 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? -72.15 -49.42 36.01 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.277 179.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 69.6 m -63.4 -41.67 98.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.18 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.1 t -62.94 -50.0 72.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.321 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -50.59 -42.37 55.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.564 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -70.64 -29.17 65.46 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.636 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.566 HD11 HG12 ' A' ' 52' ' ' ILE . 7.0 tt -67.86 -49.23 63.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.948 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.45 ' CD2' ' CE1' ' A' ' 34' ' ' PHE . 6.8 mt -61.78 -46.64 88.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.128 0.49 . . . . 0.0 109.797 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 12.1 p -54.94 -42.52 72.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.452 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.84 -47.33 81.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.348 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.495 ' CD2' HG22 ' A' ' 38' ' ' VAL . 4.2 mt -59.03 -45.15 91.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.439 179.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -55.83 -39.39 71.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.333 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.12 -30.84 70.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.818 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 43.6 mttt . . . . . 0 C--N 1.331 -0.201 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.958 179.727 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.441 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.1 p . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.884 0.373 . . . . 0.0 110.945 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.489 ' HG ' HG21 ' A' ' 66' ' ' ILE . 30.0 mt -60.14 -32.86 71.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.86 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 40.4 t -59.83 -52.33 62.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.096 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -53.76 -46.41 70.92 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.009 0.433 . . . . 0.0 110.657 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.487 ' CG1' ' HE3' ' A' ' 63' ' ' MET . 10.7 t -59.45 -43.24 90.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.436 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.93 -36.26 91.84 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.604 -0.808 . . . . 0.0 111.763 179.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -49.06 76.98 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.98 0.419 . . . . 0.0 110.218 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.97 HD13 HD13 ' A' ' 83' ' ' LEU . 6.6 mt -62.16 -38.8 90.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.945 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.522 ' HG2' HG21 ' A' ' 59' ' ' ILE . 0.4 OUTLIER -53.68 -37.79 63.56 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.757 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.42 -40.53 81.17 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.793 178.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -62.54 -36.91 84.11 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.046 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.443 HD11 ' HB2' ' A' ' 55' ' ' LEU . 3.3 mm? -62.61 -48.42 79.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.256 179.418 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -59.99 -35.07 74.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.361 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -60.59 -46.08 91.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.341 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.825 ' O ' HG23 ' A' ' 38' ' ' VAL . 18.9 m-85 -62.59 -41.16 98.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.415 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -57.84 -38.22 75.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.885 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.11 -54.39 30.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.554 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 29.1 t -58.33 -38.24 68.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.779 179.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.825 HG23 ' O ' ' A' ' 34' ' ' PHE . 45.2 t -74.99 -35.83 36.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.882 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.1 m -59.91 -34.88 73.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.633 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.55 -16.44 60.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.301 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.643 HD12 ' HA ' ' A' ' 38' ' ' VAL . 82.6 mt -75.51 -45.97 35.07 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.127 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 1.4 mptt 68.31 8.43 6.6 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.53 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -127.38 150.15 49.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.716 0.293 . . . . 0.0 110.684 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.63 ' O ' HG12 ' A' ' 48' ' ' VAL . . . 57.16 34.03 65.98 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.267 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.513 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 3.8 mmtp -63.01 -44.3 84.49 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.423 0.154 . . . . 0.0 111.389 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.513 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 32.2 Cg_exo -58.78 -49.18 12.22 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.495 2.13 . . . . 0.0 112.864 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -64.59 -50.09 68.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.734 0.302 . . . . 0.0 111.704 -179.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.77 HG11 HG11 ' A' ' 38' ' ' VAL . 14.7 p -66.88 -46.75 84.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.186 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.482 ' N ' HG13 ' A' ' 48' ' ' VAL . 95.7 m-20 -60.24 -28.98 68.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.833 0.349 . . . . 0.0 110.759 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 20.9 ttt-85 -74.16 -47.11 38.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.42 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.402 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 14.4 pt20 -72.37 -46.15 56.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.607 0.717 . . . . 0.0 109.268 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.612 HG13 HG22 ' A' ' 48' ' ' VAL . 1.2 mt -57.48 -39.45 68.97 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-N 114.646 -1.161 . . . . 0.0 110.459 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.452 ' O ' HG12 ' A' ' 57' ' ' ILE . 1.2 tmtt? -64.34 -47.78 78.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.592 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.494 ' HA ' HG12 ' A' ' 57' ' ' ILE . 14.2 m-20 -51.5 -49.18 62.37 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.707 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.443 ' HB2' HD11 ' A' ' 31' ' ' LEU . 14.2 mt -58.98 -40.73 85.7 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.493 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -56.99 -29.68 63.48 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.164 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.494 HG12 ' HA ' ' A' ' 54' ' ' ASN . 5.3 mm -71.19 -43.52 74.81 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.236 178.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.861 ' O ' HD12 ' A' ' 62' ' ' LEU . 28.3 t -57.94 -52.98 63.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.666 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.522 HG21 ' HG2' ' A' ' 28' ' ' LYS . 3.4 mt -58.38 -52.79 54.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.943 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.53 -36.47 71.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.492 179.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.99 -49.31 76.15 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.37 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.861 HD12 ' O ' ' A' ' 58' ' ' SER . 1.7 mp -55.21 -52.51 63.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.537 179.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.487 ' HE3' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.03 -55.93 5.12 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.131 179.853 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.53 -24.28 66.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.65 179.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.3 mtpt -82.06 -29.06 32.06 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-O 121.135 0.493 . . . . 0.0 110.488 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.659 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.1 mm -71.64 -39.5 69.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.225 -179.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -93.11 -28.28 16.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.695 -179.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.773 ' O ' HG23 ' A' ' 69' ' ' THR . 0.3 OUTLIER -103.73 24.25 11.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.759 0.314 . . . . 0.0 111.753 -179.553 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.773 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 176.92 150.09 0.15 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.057 179.488 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 1.9 mpp? -76.01 69.69 2.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.991 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.57 125.65 27.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.774 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.65 142.89 33.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.794 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.66 -35.12 60.68 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.938 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -59.28 -47.3 85.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.682 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -59.92 -32.48 70.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.465 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.602 ' CD1' HD23 ' A' ' 62' ' ' LEU . 26.9 mm -72.0 -34.27 50.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.702 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.22 -46.04 85.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.684 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -49.24 66.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.549 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.539 ' O ' HD12 ' A' ' 83' ' ' LEU . 2.4 mt-10 -56.5 -34.35 66.89 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.899 ' O ' HG23 ' A' ' 84' ' ' VAL . 16.9 t80 -64.73 -35.34 80.73 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 177.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -69.26 -37.52 77.98 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.954 178.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.19 -36.9 78.66 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 178.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.97 HD13 HD13 ' A' ' 27' ' ' LEU . 1.2 mt -75.48 -30.48 59.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.948 178.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.899 HG23 ' O ' ' A' ' 80' ' ' TYR . 93.2 t -67.88 -35.0 70.65 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.288 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.02 -49.38 37.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.206 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.9 -34.7 79.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.129 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.414 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 3.2 m -65.25 -46.35 80.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.286 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -56.36 -44.93 80.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.593 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -65.56 -30.68 71.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.689 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.569 HD23 ' C ' ' A' ' 90' ' ' LEU . 6.3 tt -64.26 -49.2 72.8 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.875 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.446 HD23 ' CD2' ' A' ' 90' ' ' LEU . 5.7 mt -60.67 -44.27 96.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.206 0.527 . . . . 0.0 110.018 179.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.52 -40.22 71.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.95 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.22 -53.7 34.01 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.083 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.418 HD13 HG22 ' A' ' 38' ' ' VAL . 67.2 mt -60.07 -38.17 82.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.736 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -54.2 48.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.909 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -56.42 -38.89 72.19 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.029 0.442 . . . . 0.0 110.314 179.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.886 179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.675 ' HB3' HG21 ' A' ' 76' ' ' ILE . 0.5 OUTLIER . . . . . 0 CA--C 1.53 0.206 0 CA-C-O 120.67 0.271 . . . . 0.0 111.098 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.7 mt -54.05 -32.83 55.74 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.098 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.524 HG13 ' N ' ' A' ' 23' ' ' LYS . 9.1 p -65.79 -47.84 84.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.251 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.524 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -59.42 -53.35 59.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.167 0.508 . . . . 0.0 110.519 179.726 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 1.052 HG12 HG23 ' A' ' 59' ' ' ILE . 3.8 t -56.79 -39.04 61.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.058 179.132 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -63.75 -37.29 94.47 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.596 -0.811 . . . . 0.0 111.158 178.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.5 m -57.09 -44.85 83.57 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 178.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.647 HD13 HD13 ' A' ' 83' ' ' LEU . 0.5 OUTLIER -61.75 -37.75 85.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.701 178.762 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.74 -40.33 69.2 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.82 -37.84 88.96 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.25 178.428 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.58 -34.31 77.54 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.861 179.066 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.818 HD22 HG23 ' A' ' 52' ' ' ILE . 9.4 mt -62.59 -50.26 71.98 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.958 179.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -57.81 -38.24 75.2 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.218 179.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.4 tptt -57.68 -44.56 85.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.295 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.818 ' O ' HG23 ' A' ' 38' ' ' VAL . 4.7 m-85 -61.22 -39.86 91.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.083 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -56.36 -43.72 79.42 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.355 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -59.9 -54.47 45.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.505 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.8 t -56.42 -37.88 53.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.687 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.974 HG21 HG11 ' A' ' 48' ' ' VAL . 60.5 t -71.79 -37.68 63.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.816 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 t -58.01 -37.25 73.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.36 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.47 -20.45 60.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.035 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.513 HD11 ' HB3' ' A' ' 94' ' ' LEU . 43.2 mt -81.73 -28.42 33.38 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.953 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.5 -75.18 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.999 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -57.82 157.04 7.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.998 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.436 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 58.57 54.78 34.96 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.512 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.44 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -87.19 -49.68 0.46 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.578 0.228 . . . . 0.0 111.324 -179.737 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 52.5 Cg_exo -53.38 -41.88 69.64 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.556 2.17 . . . . 0.0 112.647 -179.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -56.62 -50.36 72.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.967 0.413 . . . . 0.0 110.888 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.974 HG11 HG21 ' A' ' 38' ' ' VAL . 2.1 t -64.34 -56.13 17.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.613 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 49.0 m-80 -54.82 -25.44 28.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.07 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.16 -48.65 41.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.851 0.357 . . . . 0.0 111.5 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -77.19 -45.3 27.11 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-O 121.409 0.623 . . . . 0.0 109.815 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.826 ' CD1' HG12 ' A' ' 48' ' ' VAL . 4.0 mt -57.77 -35.73 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.592 179.039 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.487 ' O ' HG12 ' A' ' 57' ' ' ILE . 2.9 tmtm? -69.88 -54.25 14.32 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.329 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.526 ' HA ' HG12 ' A' ' 57' ' ' ILE . 27.2 p30 -60.74 -30.77 70.2 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.524 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.602 HD22 HD23 ' A' ' 83' ' ' LEU . 75.2 mt -72.02 -38.94 69.49 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.23 -31.13 68.77 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.526 HG12 ' HA ' ' A' ' 54' ' ' ASN . 4.8 mm -68.09 -43.64 85.1 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.294 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.691 178.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.767 ' O ' HD12 ' A' ' 62' ' ' LEU . 5.1 t -58.56 -51.34 70.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.341 179.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 1.052 HG23 HG12 ' A' ' 24' ' ' VAL . 57.3 mt -61.69 -53.4 48.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.658 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.435 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 0.4 OUTLIER -55.17 -32.7 62.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.293 179.434 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.14 -49.23 75.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.761 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.767 HD12 ' O ' ' A' ' 58' ' ' SER . 0.9 OUTLIER -56.4 -57.3 12.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.069 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.53 ' SD ' HG22 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -46.0 -53.38 10.17 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.241 0.338 . . . . 0.0 110.967 -179.882 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.92 -24.48 66.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.923 0.392 . . . . 0.0 110.863 179.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.0 mtpt -82.61 -29.21 30.3 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.196 0.522 . . . . 0.0 110.652 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.643 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.6 mm -73.02 -35.59 48.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.132 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.62 -26.34 15.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.578 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.805 ' O ' HG23 ' A' ' 69' ' ' THR . 1.1 m -106.44 22.11 16.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.703 0.287 . . . . 0.0 111.705 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.805 HG23 ' O ' ' A' ' 68' ' ' SER . 0.6 OUTLIER 177.74 155.86 0.35 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.836 179.568 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 9.2 mtp -82.59 72.48 9.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.818 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.4 mmm -68.71 134.13 49.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.96 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.59 138.84 33.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.731 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.18 -31.57 53.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.911 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.82 -43.34 98.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.641 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -68.08 -31.5 71.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.685 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.675 HG21 ' HB3' ' A' ' 20' ' ' SER . 29.7 mm -71.82 -38.08 64.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.869 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -52.07 56.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.899 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.74 -48.85 79.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.721 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -56.35 -32.6 64.86 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 178.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.908 ' O ' HG23 ' A' ' 84' ' ' VAL . 1.9 t80 -64.65 -35.9 82.53 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 177.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -69.57 -37.66 77.06 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.057 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.05 -36.08 76.52 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 121.186 0.517 . . . . 0.0 109.678 178.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.647 HD13 HD13 ' A' ' 27' ' ' LEU . 3.0 mt -76.2 -30.54 58.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.004 178.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.908 HG23 ' O ' ' A' ' 80' ' ' TYR . 60.9 t -68.97 -35.84 71.09 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.457 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.01 -49.24 38.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.086 0.469 . . . . 0.0 110.322 179.52 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.1 p -65.01 -41.6 95.19 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.212 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.5 m -64.54 -50.17 68.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.587 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -51.97 -41.99 62.56 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.676 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.96 -30.64 68.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.723 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 tt -64.91 -48.98 72.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.431 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.9 mt -62.06 -49.57 75.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.068 0.461 . . . . 0.0 109.977 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.4 m -56.49 -30.7 63.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.72 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.49 ' HA ' ' HG2' ' A' ' 96' ' ' LYS . . . -69.88 -53.28 18.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.159 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.513 ' HB3' HD11 ' A' ' 41' ' ' LEU . 2.8 mt -61.87 -45.61 93.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.044 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -62.11 -44.93 95.58 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.207 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.49 ' HG2' ' HA ' ' A' ' 93' ' ' ALA . 1.3 pttm -61.68 -29.49 70.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.936 0.398 . . . . 0.0 110.184 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.9 mtmm . . . . . 0 C--N 1.332 -0.181 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.109 179.683 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.744 0.307 . . . . 0.0 110.78 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.562 ' HG ' HG21 ' A' ' 66' ' ' ILE . 10.4 mt -55.88 -32.94 64.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.046 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.495 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.6 p -63.84 -45.75 96.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.013 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.495 ' N ' HG13 ' A' ' 22' ' ' VAL . 21.1 mttt -60.3 -49.27 78.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.094 0.473 . . . . 0.0 110.48 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.458 ' CG1' HG23 ' A' ' 59' ' ' ILE . 21.6 t -56.96 -43.48 80.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.403 179.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.02 -38.05 95.44 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.645 -0.788 . . . . 0.0 111.452 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.2 m -56.76 -45.63 81.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.084 0.468 . . . . 0.0 109.938 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.85 ' CD2' HD13 ' A' ' 83' ' ' LEU . 8.6 tp -61.91 -38.37 88.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.895 179.119 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -41.22 67.94 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 178.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -65.06 -37.93 89.18 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.471 178.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.02 -33.39 75.94 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.929 178.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.782 HD12 HD12 ' A' ' 59' ' ' ILE . 5.1 mt -62.17 -51.91 65.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.166 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -57.91 -36.78 72.93 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.211 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.456 ' O ' HG23 ' A' ' 37' ' ' VAL . 22.1 tptt -58.61 -43.97 89.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.469 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.826 ' O ' HG23 ' A' ' 38' ' ' VAL . 16.2 m-85 -62.72 -42.56 99.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.424 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -54.13 -45.64 71.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.838 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -55.27 32.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.895 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 33' ' ' LYS . 31.5 t -55.94 -38.69 53.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.914 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.858 HG11 HG11 ' A' ' 48' ' ' VAL . 46.6 t -75.19 -33.81 29.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.75 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.0 t -61.2 -33.29 73.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.512 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.2 -29.95 67.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.779 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.55 79.92 1.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.797 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.45 -27.9 2.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.396 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -56.38 107.39 0.37 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.967 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.586 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 80.89 54.59 3.58 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.321 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.491 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -82.61 -45.97 0.92 Allowed Pre-proline 0 C--N 1.329 -0.301 0 N-CA-C 111.44 0.163 . . . . 0.0 111.44 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 52.7 Cg_exo -53.19 -43.75 54.61 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.296 1.998 . . . . 0.0 112.424 -179.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -58.37 -49.53 76.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.941 0.401 . . . . 0.0 110.622 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.858 HG11 HG11 ' A' ' 38' ' ' VAL . 4.9 t -60.86 -54.93 28.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.74 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.429 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 21.2 m-80 -54.02 -25.73 22.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.032 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.83 -51.74 20.96 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.955 0.407 . . . . 0.0 111.52 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -73.26 -45.41 55.95 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.469 0.652 . . . . 0.0 109.276 179.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.652 HG13 HG12 ' A' ' 48' ' ' VAL . 1.4 mt -57.51 -31.95 40.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.312 178.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 25.6 tttt -69.32 -52.41 27.59 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.475 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.914 ' HA ' HD12 ' A' ' 57' ' ' ILE . 17.9 m-20 -51.14 -41.68 60.25 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.834 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.8 mp -68.86 -42.98 76.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.256 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.402 ' HA ' ' CD1' ' A' ' 31' ' ' LEU . 0.5 OUTLIER -56.75 -36.6 69.95 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 178.579 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.914 HD12 ' HA ' ' A' ' 54' ' ' ASN . 11.8 mt -71.31 -42.43 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.329 178.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.855 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.1 m -59.73 -54.97 40.12 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.722 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.782 HD12 HD12 ' A' ' 31' ' ' LEU . 45.6 mt -58.5 -53.94 39.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.879 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.9 -34.39 67.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.578 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.58 -49.62 76.8 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.244 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.855 HD12 ' O ' ' A' ' 58' ' ' SER . 2.1 mp -55.53 -54.73 40.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.463 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.45 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -44.86 -57.0 4.04 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.19 -179.839 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.06 -24.8 64.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.832 0.348 . . . . 0.0 110.599 179.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.488 ' HA ' HG23 ' A' ' 69' ' ' THR . 15.7 mtpt -81.96 -29.76 32.02 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.624 179.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -71.88 -33.76 49.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.076 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 21.2 mmmt -93.82 -2.51 53.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.273 -179.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.515 ' O ' HG22 ' A' ' 69' ' ' THR . 13.0 m -140.17 19.87 2.43 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.515 HG22 ' O ' ' A' ' 68' ' ' SER . 0.4 OUTLIER -161.64 161.72 29.68 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.495 179.281 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -95.23 45.65 1.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.028 0.442 . . . . 0.0 110.58 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.84 130.43 29.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.215 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.6 m -80.08 142.38 34.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.747 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -30.52 59.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.74 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -47.25 86.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.434 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -64.31 -32.82 74.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.434 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.653 ' CD1' HD23 ' A' ' 62' ' ' LEU . 25.4 mm -70.59 -36.81 67.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.742 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -63.32 -52.21 62.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.77 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.8 tptt -62.18 -46.62 88.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.561 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -56.45 -33.31 65.77 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.902 ' O ' HG23 ' A' ' 84' ' ' VAL . 2.1 t80 -64.35 -37.5 87.74 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 177.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.86 -36.54 75.6 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.977 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.45 -36.07 75.24 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.247 0.546 . . . . 0.0 109.794 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.85 HD13 ' CD2' ' A' ' 27' ' ' LEU . 2.7 mt -76.74 -31.18 56.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.032 179.019 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.902 HG23 ' O ' ' A' ' 80' ' ' TYR . 47.7 t -69.83 -35.14 63.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.617 179.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -72.21 -49.46 35.22 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.447 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.4 m -66.03 -40.33 90.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.435 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.417 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 28.4 t -64.89 -50.06 68.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.607 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -52.84 -44.43 66.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.842 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -69.41 -27.68 65.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.82 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.594 HD11 HG12 ' A' ' 52' ' ' ILE . 7.3 tt -67.73 -49.22 63.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.067 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.9 mt -62.3 -49.11 76.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.175 0.512 . . . . 0.0 109.863 179.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.3 m -55.42 -37.65 67.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.46 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.4 -40.28 74.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.827 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.575 ' CD2' HG22 ' A' ' 38' ' ' VAL . 10.6 tp -62.64 -51.8 65.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -55.91 -50.53 70.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.618 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -58.81 -28.98 66.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.128 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.8 tttm . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.611 179.517 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.669 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.9 p . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.795 0.331 . . . . 0.0 110.838 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.517 ' HG ' HG21 ' A' ' 66' ' ' ILE . 3.4 mp -64.38 -32.64 74.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.029 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 32.4 t -62.5 -52.78 55.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.291 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.2 tptt -54.17 -45.22 72.04 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.919 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.779 HG12 HG23 ' A' ' 59' ' ' ILE . 11.5 t -56.73 -49.15 79.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.296 179.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.9 -40.07 98.37 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.554 -0.831 . . . . 0.0 111.559 178.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.808 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.1 OUTLIER -56.71 -42.32 78.97 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.253 0.549 . . . . 0.0 109.716 179.269 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.65 HD13 HD13 ' A' ' 83' ' ' LEU . 0.8 OUTLIER -59.91 -39.63 86.09 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.181 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -53.88 -35.02 61.14 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.808 ' HG3' ' HA ' ' A' ' 26' ' ' THR . 2.6 mmtt -60.17 -48.26 82.48 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.366 -0.833 . . . . 0.0 109.14 177.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.94 -33.86 62.66 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.402 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.542 HD13 HD11 ' A' ' 59' ' ' ILE . 1.4 mp -63.47 -49.74 72.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.244 179.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.67 -32.91 70.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.324 179.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 tppt? -61.91 -45.93 91.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.284 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.792 ' O ' HG23 ' A' ' 38' ' ' VAL . 8.5 m-85 -60.09 -50.17 74.77 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.659 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -54.22 -38.6 65.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.918 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -51.71 68.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.014 0.435 . . . . 0.0 110.599 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.451 HG12 HD23 ' A' ' 41' ' ' LEU . 30.7 t -62.67 -37.85 80.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.736 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 1.034 HG22 HD21 ' A' ' 94' ' ' LEU . 59.9 t -63.07 -36.22 74.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.954 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.5 m -75.83 -29.22 58.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.926 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.22 -29.21 38.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.376 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.51 ' C ' HD12 ' A' ' 41' ' ' LEU . 3.6 pp -93.4 -35.94 12.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.999 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.49 ' N ' HD12 ' A' ' 41' ' ' LEU . 1.3 mptt 58.41 102.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.97 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 174.9 122.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.729 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.633 ' O ' HG12 ' A' ' 48' ' ' VAL . . . 58.14 68.09 1.87 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.477 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.468 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -69.5 -47.59 25.87 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 111.553 0.205 . . . . 0.0 111.553 -179.705 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.468 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 35.8 Cg_exo -60.52 -49.38 9.04 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.504 2.136 . . . . 0.0 113.07 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 2.0 pm0 -58.21 -50.03 74.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.845 0.355 . . . . 0.0 111.649 -179.135 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.755 HG11 HG11 ' A' ' 38' ' ' VAL . 14.6 p -72.66 -46.55 53.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.343 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.483 ' N ' HG13 ' A' ' 48' ' ' VAL . 98.9 m-20 -59.43 -39.0 82.14 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.992 -0.283 . . . . 0.0 111.528 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.423 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 27.8 ptt180 -71.48 -41.85 68.83 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -179.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.404 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 28.9 mt-30 -71.78 -46.87 56.94 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 179.187 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.641 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.1 mt -57.33 -30.0 34.43 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.059 178.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.499 ' HD3' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -69.07 -51.15 41.72 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.342 179.035 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.911 ' HA ' HD12 ' A' ' 57' ' ' ILE . 16.2 m-20 -51.5 -41.44 60.99 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.601 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 26.3 mt -67.41 -43.83 80.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.219 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.486 ' N ' HD21 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -56.74 -37.56 71.17 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.515 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.911 HD12 ' HA ' ' A' ' 54' ' ' ASN . 9.7 mt -71.26 -40.76 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.134 178.557 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.841 ' O ' HD12 ' A' ' 62' ' ' LEU . 39.9 t -57.83 -53.01 63.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.477 179.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.779 HG23 HG12 ' A' ' 24' ' ' VAL . 4.4 mt -60.39 -52.98 55.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.568 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.77 -33.67 68.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.465 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.84 -49.36 78.01 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.271 179.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.841 HD12 ' O ' ' A' ' 58' ' ' SER . 1.2 mp -55.42 -55.1 35.6 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.703 179.448 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.426 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -44.93 -58.54 3.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.164 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.49 -23.8 63.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.683 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.512 ' HA ' HG23 ' A' ' 69' ' ' THR . 1.0 OUTLIER -82.48 -29.79 30.34 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.545 179.511 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.662 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.9 mm -71.63 -35.78 57.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.236 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.7 mmmt -96.07 1.41 52.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.347 -179.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.488 ' O ' HG22 ' A' ' 69' ' ' THR . 19.5 m -141.93 23.33 2.07 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.512 HG23 ' HA ' ' A' ' 65' ' ' LYS . 0.7 OUTLIER -160.39 174.03 14.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.924 0.392 . . . . 0.0 110.756 179.239 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.17 38.2 2.27 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.643 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.0 mmm -55.52 141.3 37.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.059 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.3 m -84.9 145.25 27.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.754 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.4 -31.46 61.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.755 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.11 -37.9 84.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.394 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -68.59 -32.57 72.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.515 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.6 ' CD1' HD23 ' A' ' 62' ' ' LEU . 25.6 mm -72.51 -34.48 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.717 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.02 -50.72 61.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.66 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.9 -46.3 88.47 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.5 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -56.45 -34.22 66.64 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.913 ' O ' HG23 ' A' ' 84' ' ' VAL . 3.3 t80 -64.15 -37.06 86.11 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 177.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.43 -36.89 77.1 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.938 178.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.59 -36.33 76.06 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.126 0.488 . . . . 0.0 109.687 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.65 HD13 HD13 ' A' ' 27' ' ' LEU . 4.7 mt -76.43 -32.42 58.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.917 178.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.913 HG23 ' O ' ' A' ' 80' ' ' TYR . 58.9 t -67.95 -34.3 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.428 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -48.81 39.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.357 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.14 -38.51 91.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.574 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.444 ' HB2' ' CZ ' ' A' ' 34' ' ' PHE . 25.6 p -66.13 -46.49 77.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.596 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.81 -44.21 73.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.972 0.415 . . . . 0.0 110.559 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -67.93 -30.57 69.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.681 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.598 HD11 HD11 ' A' ' 52' ' ' ILE . 7.6 tt -62.77 -47.75 82.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.739 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.666 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.8 mt -62.41 -49.19 76.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.124 0.488 . . . . 0.0 109.708 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 24.1 m -57.1 -40.34 76.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.473 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.73 -51.71 46.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.712 179.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 1.034 HD21 HG22 ' A' ' 38' ' ' VAL . 1.2 mp -53.48 -51.6 62.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.794 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -55.67 -40.27 72.06 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.089 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.05 -53.28 60.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.61 179.351 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.4 mttt . . . . . 0 C--N 1.326 -0.44 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.196 -179.802 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.694 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.4 m . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.857 0.361 . . . . 0.0 110.911 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.457 HD21 ' HB ' ' A' ' 66' ' ' ILE . 1.1 mt -66.13 -32.89 74.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.014 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.529 HG13 ' N ' ' A' ' 23' ' ' LYS . 9.1 p -60.63 -49.42 84.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.358 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.529 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -64.32 -46.4 83.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.852 0.358 . . . . 0.0 110.648 179.8 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.694 HG23 ' O ' ' A' ' 20' ' ' SER . 44.4 t -56.84 -40.68 72.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.203 179.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.14 -41.98 96.72 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.646 -0.787 . . . . 0.0 111.424 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.606 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -57.97 -33.26 68.68 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.133 0.492 . . . . 0.0 109.998 179.2 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.887 ' CD2' HD13 ' A' ' 83' ' ' LEU . 13.6 tp -67.98 -45.49 73.98 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.0 mttm -52.8 -33.67 50.04 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.606 ' HG3' ' HA ' ' A' ' 26' ' ' THR . 15.7 mttt -63.52 -47.27 82.35 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.831 178.321 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.453 ' HG2' ' CZ ' ' A' ' 34' ' ' PHE . 63.1 ttt180 -61.34 -32.28 72.16 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.409 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.446 HD23 ' HG2' ' A' ' 56' ' ' GLU . 4.2 mp -62.47 -50.6 70.81 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.268 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -58.03 -37.64 74.74 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.12 0.486 . . . . 0.0 109.915 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.423 ' O ' HG23 ' A' ' 37' ' ' VAL . 24.7 tptt -57.75 -42.83 84.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.061 179.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.854 ' O ' HG23 ' A' ' 38' ' ' VAL . 18.9 m-30 -62.5 -42.46 99.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.254 179.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -53.19 -46.14 68.88 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.649 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -59.98 -54.32 47.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.505 179.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 33' ' ' LYS . 35.8 t -56.05 -37.86 50.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.559 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.939 HG11 HG11 ' A' ' 48' ' ' VAL . 44.5 t -74.09 -33.53 35.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.583 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.3 t -61.76 -32.93 73.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.313 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.28 -27.44 56.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.212 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.657 HD11 ' HB3' ' A' ' 94' ' ' LEU . 18.7 mt -59.78 -45.76 91.29 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.929 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 63.61 14.7 8.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.487 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -133.55 134.14 42.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.849 0.357 . . . . 0.0 110.9 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.551 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 59.0 69.81 1.17 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.487 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.528 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 2.0 mmpm? -82.93 -42.99 0.88 Allowed Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.1 Cg_exo -53.6 -49.0 18.85 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.301 2.0 . . . . 0.0 112.374 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.436 ' HA ' ' HG2' ' A' ' 50' ' ' ARG . 0.9 OUTLIER -55.6 -46.93 77.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.011 0.434 . . . . 0.0 111.076 179.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.939 HG11 HG11 ' A' ' 38' ' ' VAL . 11.8 t -65.83 -55.69 18.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.136 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -53.43 -34.9 59.59 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -179.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.448 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 5.3 ptp85 -74.37 -35.23 63.53 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -179.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.448 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 26.2 mt-30 -80.71 -47.56 13.81 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.554 0.692 . . . . 0.0 109.531 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.624 HG13 ' O ' ' A' ' 48' ' ' VAL . 2.6 mt -60.23 -33.67 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.101 178.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.03 -54.13 14.53 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.265 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.96 ' HA ' HD12 ' A' ' 57' ' ' ILE . 26.8 p30 -59.01 -25.48 63.69 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.738 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.547 HD22 HD23 ' A' ' 83' ' ' LEU . 84.6 mt -79.27 -44.44 21.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.356 . . . . 0.0 110.102 178.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.446 ' HG2' HD23 ' A' ' 31' ' ' LEU . 1.8 tm-20 -56.71 -35.67 68.8 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.96 HD12 ' HA ' ' A' ' 54' ' ' ASN . 12.0 mt -70.54 -41.88 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.127 178.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.69 ' O ' HD12 ' A' ' 62' ' ' LEU . 24.2 m -58.69 -55.14 38.91 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.472 179.569 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.562 HG12 HD23 ' A' ' 27' ' ' LEU . 4.0 mt -60.61 -52.51 60.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.63 179.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -58.48 -34.1 70.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.505 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.33 -49.63 76.51 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.024 0.44 . . . . 0.0 110.023 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.69 HD12 ' O ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -55.61 -52.81 62.52 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.277 178.967 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.497 ' HE2' HG11 ' A' ' 24' ' ' VAL . 17.7 tpp -45.02 -57.92 3.52 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.211 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.9 -24.2 64.1 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.619 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.469 ' HA ' HG23 ' A' ' 69' ' ' THR . 2.8 mtmp? -81.97 -29.78 31.98 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.539 179.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.655 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.8 mm -71.63 -36.38 59.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.095 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt -96.18 1.23 52.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.945 -0.571 . . . . 0.0 112.265 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.49 ' O ' HG22 ' A' ' 69' ' ' THR . 3.0 t -138.46 20.49 2.74 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.49 HG22 ' O ' ' A' ' 68' ' ' SER . 0.7 OUTLIER -160.84 177.08 10.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.888 0.375 . . . . 0.0 110.649 179.405 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.3 ttt -109.21 41.39 1.64 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.536 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 15.3 mmm -55.49 145.02 23.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.138 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.48 146.65 23.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.797 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 86.4 mtm-85 -54.75 -31.37 58.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.797 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.8 -39.0 87.26 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.414 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -67.47 -34.3 76.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.433 179.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.571 HD13 HD23 ' A' ' 62' ' ' LEU . 26.1 mm -72.09 -34.0 48.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.721 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -66.68 -46.34 75.95 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.801 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 4.8 mmmt -66.54 -47.54 72.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.694 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.66 -34.18 67.09 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.809 ' O ' HG23 ' A' ' 84' ' ' VAL . 88.3 t80 -64.96 -36.67 85.13 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.77 -37.79 76.52 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.936 178.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.98 -32.26 71.82 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.111 0.481 . . . . 0.0 109.758 178.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.887 HD13 ' CD2' ' A' ' 27' ' ' LEU . 5.0 mt -78.31 -30.62 48.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.021 178.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.809 HG23 ' O ' ' A' ' 80' ' ' TYR . 60.2 t -68.97 -37.05 76.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.368 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -49.15 35.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.452 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.7 p -64.47 -45.28 88.05 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.727 179.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 89.4 p -60.21 -49.28 78.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.56 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -54.5 -39.52 67.64 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.764 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -68.12 -31.63 71.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.753 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.447 HD23 HD23 ' A' ' 91' ' ' LEU . 6.8 tt -66.05 -46.46 77.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.997 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.447 HD23 HD23 ' A' ' 90' ' ' LEU . 6.5 mt -65.14 -48.52 73.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.169 0.509 . . . . 0.0 109.809 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.3 m -57.07 -32.68 66.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.539 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.416 ' O ' ' CG ' ' A' ' 96' ' ' LYS . . . -70.07 -53.11 18.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.777 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.657 ' HB3' HD11 ' A' ' 41' ' ' LEU . 14.4 mt -58.87 -42.2 88.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.672 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.97 -49.71 75.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.036 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.416 ' CG ' ' O ' ' A' ' 93' ' ' ALA . 27.3 pttt -61.61 -28.65 69.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.939 0.399 . . . . 0.0 110.46 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mttm . . . . . 0 C--N 1.332 -0.19 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.692 -179.783 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.885 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.5 m . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.766 0.317 . . . . 0.0 110.83 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.703 ' HG ' HG21 ' A' ' 66' ' ' ILE . 2.6 mt -57.06 -35.97 69.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.072 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.503 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.8 p -69.34 -46.69 76.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.191 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.503 ' N ' HG13 ' A' ' 22' ' ' VAL . 25.2 mttt -60.15 -46.52 89.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.168 0.509 . . . . 0.0 110.506 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.885 HG23 ' O ' ' A' ' 20' ' ' SER . 14.4 t -56.83 -45.97 83.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.632 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.76 -38.77 95.75 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.55 -0.833 . . . . 0.0 111.704 179.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -56.89 -43.85 81.74 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.057 0.456 . . . . 0.0 110.153 179.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.464 HD13 HD13 ' A' ' 83' ' ' LEU . 0.7 OUTLIER -61.63 -42.02 98.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.054 179.254 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.427 ' HA ' HD13 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -52.88 -40.07 63.19 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 178.786 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.53 -38.64 91.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.63 178.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.431 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -63.48 -36.56 84.16 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.922 179.12 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.732 HD22 HD12 ' A' ' 59' ' ' ILE . 5.9 mp -62.03 -43.52 98.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.254 179.334 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.28 -47.42 85.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.843 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.454 ' O ' HG23 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -60.06 -33.64 72.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.006 -179.991 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.848 ' O ' HG23 ' A' ' 38' ' ' VAL . 10.8 m-85 -65.59 -43.91 88.25 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.512 179.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -60.77 -39.3 88.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.476 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -59.15 -54.69 44.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.478 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 33' ' ' LYS . 24.0 t -58.8 -37.9 69.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.781 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.901 HG11 HG11 ' A' ' 48' ' ' VAL . 55.0 t -70.74 -31.45 45.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.061 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.3 m -73.82 -27.1 60.94 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.98 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.45 -34.86 65.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.413 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.79 HD12 ' O ' ' A' ' 42' ' ' LYS . 4.1 pp -87.79 -25.98 23.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.284 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.79 ' O ' HD12 ' A' ' 41' ' ' LEU . 4.7 mptt 58.55 179.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.974 0.416 . . . . 0.0 111.114 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.5 t70 70.13 149.12 0.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.749 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.595 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 62.47 24.76 66.2 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.375 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.454 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -54.3 -48.93 93.12 Favored Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 111.516 0.191 . . . . 0.0 111.516 -179.836 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 50.5 Cg_exo -53.79 -46.84 30.73 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.292 1.995 . . . . 0.0 112.581 -179.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -63.12 -50.44 70.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.412 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.901 HG11 HG11 ' A' ' 38' ' ' VAL . 11.9 t -65.11 -55.78 18.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.148 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.629 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 73.6 m-20 -54.07 -28.42 38.82 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.224 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.4 -49.54 33.07 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.416 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 28.4 mt-30 -74.15 -43.5 57.2 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.532 0.682 . . . . 0.0 109.588 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.605 HG13 HG12 ' A' ' 48' ' ' VAL . 1.2 mt -57.15 -36.2 50.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.376 179.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.933 ' HD2' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -69.08 -46.02 68.84 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.187 178.835 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.912 ' HA ' HD12 ' A' ' 57' ' ' ILE . 27.7 m-20 -51.19 -41.34 60.15 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.732 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.592 ' HB2' HD21 ' A' ' 31' ' ' LEU . 5.3 mt -69.25 -43.3 74.25 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 120.722 0.296 . . . . 0.0 110.351 179.33 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.443 ' N ' HD21 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -56.56 -36.43 69.31 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.606 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.933 HD11 ' HD2' ' A' ' 53' ' ' LYS . 10.9 mt -70.96 -42.25 77.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 115.096 -0.957 . . . . 0.0 110.171 178.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.904 ' O ' HD12 ' A' ' 62' ' ' LEU . 10.5 m -59.49 -46.12 89.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.419 179.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.779 HG23 HG12 ' A' ' 24' ' ' VAL . 46.3 mt -63.97 -53.49 43.37 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.527 179.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.435 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 96.0 m-20 -57.26 -34.19 68.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.301 179.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.88 -49.1 78.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.783 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.904 HD12 ' O ' ' A' ' 58' ' ' SER . 0.8 OUTLIER -55.78 -56.49 19.93 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.998 179.929 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.439 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.6 -53.78 8.62 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 123.198 0.311 . . . . 0.0 110.792 -179.92 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.07 -25.19 66.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.927 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.447 ' O ' HG23 ' A' ' 69' ' ' THR . 2.3 mtmp? -82.35 -30.42 30.38 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.137 0.494 . . . . 0.0 110.596 179.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.703 HG21 ' HG ' ' A' ' 21' ' ' LEU . 1.5 mm -71.22 -33.81 52.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.99 -179.495 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.81 0.95 57.51 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.214 -179.302 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.471 ' O ' HG22 ' A' ' 69' ' ' THR . 2.2 m -142.88 22.12 1.94 Allowed 'General case' 0 C--O 1.233 0.192 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.471 HG22 ' O ' ' A' ' 68' ' ' SER . 1.0 OUTLIER -160.34 157.4 27.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.605 179.206 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.63 36.49 1.77 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.49 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.7 138.71 55.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.071 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.43 HG22 ' H ' ' A' ' 74' ' ' GLU . 13.9 m -74.32 145.71 43.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.806 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.26 -30.61 62.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.668 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.43 ' H ' HG22 ' A' ' 72' ' ' THR . 1.4 tt0 -59.37 -45.1 92.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.427 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -60.24 -33.58 72.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.376 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.667 ' CD1' HD23 ' A' ' 62' ' ' LEU . 19.1 mm -70.88 -34.07 54.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.497 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -50.88 68.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.609 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.8 mmtm -61.14 -46.34 90.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.47 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -56.52 -33.47 66.08 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.925 ' O ' HG23 ' A' ' 84' ' ' VAL . 2.5 t80 -63.81 -38.08 89.78 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 177.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.6 -36.36 76.14 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.144 178.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.97 -37.36 76.6 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.253 0.549 . . . . 0.0 109.921 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.71 HD21 ' HB2' ' A' ' 58' ' ' SER . 24.8 mt -76.48 -30.08 57.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.112 178.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.925 HG23 ' O ' ' A' ' 80' ' ' TYR . 49.0 t -71.11 -34.66 55.74 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.543 179.426 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -72.02 -49.28 38.27 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.436 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.5 m -62.95 -40.81 98.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.28 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.404 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 3.0 m -62.93 -50.07 72.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.513 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -52.38 -41.75 63.39 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.021 0.439 . . . . 0.0 110.747 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -67.5 -32.74 73.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.688 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.515 HD23 HD12 ' A' ' 94' ' ' LEU . 5.1 tt -64.98 -47.08 78.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.964 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.75 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.7 mt -60.88 -48.79 80.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.238 0.542 . . . . 0.0 109.982 179.63 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.04 -42.69 72.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.334 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.91 -36.83 84.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.316 179.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.671 HD22 HD21 ' A' ' 41' ' ' LEU . 5.9 mt -66.91 -42.68 85.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.427 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.95 -54.19 47.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.325 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.77 -28.74 69.66 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.261 179.187 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.3 tttm . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.156 179.992 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.41 ' O ' HG23 ' A' ' 24' ' ' VAL . 2.4 m . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.672 0.272 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.614 HD21 ' HB ' ' A' ' 66' ' ' ILE . 0.5 OUTLIER -53.67 -32.76 52.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.085 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.515 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.0 p -57.74 -48.35 83.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.303 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.515 ' N ' HG13 ' A' ' 22' ' ' VAL . 22.0 mttt -64.48 -41.92 96.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.888 0.375 . . . . 0.0 110.421 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.584 HG12 HG23 ' A' ' 59' ' ' ILE . 25.5 t -57.48 -48.49 82.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.703 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -59.35 -41.22 96.83 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.624 -0.798 . . . . 0.0 111.801 179.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.69 -36.3 74.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.905 0.383 . . . . 0.0 110.263 179.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.521 HD13 HD13 ' A' ' 83' ' ' LEU . 0.4 OUTLIER -64.59 -47.01 80.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.752 179.336 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.53 ' HA ' HD13 ' A' ' 59' ' ' ILE . 5.4 tttm -53.18 -36.37 60.86 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -68.72 -35.11 76.72 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.451 178.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -34.48 77.86 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.893 178.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.568 HD21 ' HB2' ' A' ' 55' ' ' LEU . 6.2 mp -63.71 -50.36 69.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.128 179.251 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -58.02 -35.76 71.73 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.19 179.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.9 tptt -60.4 -46.13 91.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.348 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.842 ' O ' HG23 ' A' ' 38' ' ' VAL . 21.3 m-85 -59.59 -42.7 93.14 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.49 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -58.28 -40.77 82.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.474 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -59.47 -49.74 76.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.508 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.4 t -63.2 -37.9 80.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.505 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.842 HG23 ' O ' ' A' ' 34' ' ' PHE . 57.2 t -68.23 -38.26 79.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.787 179.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.3 m -67.58 -30.72 70.41 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.738 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.57 -29.74 69.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.276 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.573 HD12 ' O ' ' A' ' 42' ' ' LYS . 1.2 pp -100.99 -22.52 14.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.208 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.573 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.2 OUTLIER 63.08 -173.82 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.912 179.902 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 62.24 155.46 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.758 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.811 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 63.7 33.16 86.51 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.319 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.568 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 16.8 mmtp -62.97 -55.29 38.98 Favored Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.568 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 10.0 Cg_endo -53.55 -43.03 61.13 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.561 2.174 . . . . 0.0 112.856 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -66.5 -41.02 89.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.786 0.327 . . . . 0.0 111.185 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 44' ' ' GLY . 47.4 t -71.19 -56.24 11.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.45 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.466 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 21.1 p30 -59.26 -25.46 64.08 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.946 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 11.1 ttt-85 -72.92 -47.14 48.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.778 0.323 . . . . 0.0 111.386 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -76.64 -46.05 27.46 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.421 0.629 . . . . 0.0 109.598 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.762 ' HA ' HD12 ' A' ' 55' ' ' LEU . 1.8 mt -57.39 -34.09 45.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.372 179.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.688 ' HG3' HD11 ' A' ' 57' ' ' ILE . 4.9 tptt -69.41 -52.36 27.69 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.534 179.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.927 ' HA ' HD12 ' A' ' 57' ' ' ILE . 15.2 m-20 -51.52 -34.16 34.94 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.539 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.762 HD12 ' HA ' ' A' ' 52' ' ' ILE . 2.9 mt -76.63 -43.26 39.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.392 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.567 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -56.71 -35.0 68.01 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.415 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.927 HD12 ' HA ' ' A' ' 54' ' ' ASN . 14.0 mt -70.49 -43.49 77.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.187 178.728 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.887 ' O ' HD12 ' A' ' 62' ' ' LEU . 6.7 t -57.91 -45.92 85.77 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.681 179.576 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.584 HG23 HG12 ' A' ' 24' ' ' VAL . 13.9 mt -59.94 -54.47 34.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.757 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -57.54 -33.52 68.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.622 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.81 -49.55 77.27 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.474 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.887 HD12 ' O ' ' A' ' 58' ' ' SER . 1.5 mp -55.73 -55.03 37.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.695 179.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.494 ' HE2' HG11 ' A' ' 24' ' ' VAL . 9.3 tpp -45.12 -55.57 5.56 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.267 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.89 -24.24 66.82 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.805 0.336 . . . . 0.0 110.546 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.6 mtmm -82.25 -28.91 31.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.473 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.653 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.1 mm -71.88 -40.65 68.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.336 -179.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -92.56 -29.05 16.38 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.773 -179.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.762 ' O ' HG23 ' A' ' 69' ' ' THR . 1.2 t -103.14 24.41 10.89 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.714 0.264 . . . . 0.0 111.714 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.762 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 177.53 150.14 0.18 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.156 179.623 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 11.0 ttp -75.17 64.37 1.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.872 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.515 ' CE ' HD13 ' A' ' 76' ' ' ILE . 0.5 OUTLIER -62.63 124.49 21.12 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.779 179.992 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.8 m -77.11 136.38 38.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.771 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.3 mtm180 -52.77 -35.29 56.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.911 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -59.94 -42.34 93.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.458 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -67.22 -32.59 73.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.515 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.564 HD13 HD23 ' A' ' 62' ' ' LEU . 27.1 mm -70.11 -37.13 71.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.828 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -65.1 -50.36 66.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.692 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -63.57 -46.9 83.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.675 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.427 ' O ' HD12 ' A' ' 83' ' ' LEU . 1.1 mt-10 -56.46 -34.0 66.45 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.933 ' O ' HG23 ' A' ' 84' ' ' VAL . 3.5 t80 -64.15 -37.36 87.16 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -69.72 -36.8 76.2 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.17 178.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.74 -39.89 78.41 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.249 0.547 . . . . 0.0 109.681 179.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.716 HD21 ' HB3' ' A' ' 58' ' ' SER . 1.4 mt -74.34 -30.19 61.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.062 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.933 HG23 ' O ' ' A' ' 80' ' ' TYR . 57.3 t -70.2 -36.2 66.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.413 179.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.71 -49.43 58.97 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.204 179.467 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.439 ' CB ' HD21 ' A' ' 55' ' ' LEU . 58.5 m -63.95 -43.6 95.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.982 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.43 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 67.3 m -60.98 -50.0 75.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.338 179.329 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -50.3 -43.66 53.76 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.637 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -37.28 86.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.464 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.525 HD23 ' C ' ' A' ' 90' ' ' LEU . 5.9 tt -62.98 -44.14 96.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.929 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.489 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.5 mt -62.63 -48.67 78.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.08 0.466 . . . . 0.0 109.918 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.2 t -57.2 -43.58 82.85 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.645 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.07 -46.17 82.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.797 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.515 ' CD2' HG22 ' A' ' 38' ' ' VAL . 3.4 tp -61.67 -44.97 95.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.827 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.83 -44.86 78.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.775 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -58.4 -48.92 79.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.524 179.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.217 -179.958 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.699 ' O ' HG23 ' A' ' 24' ' ' VAL . 2.1 m . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.806 0.336 . . . . 0.0 110.971 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.471 HD22 ' HG3' ' A' ' 63' ' ' MET . 17.7 mt -53.85 -32.86 54.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.109 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.507 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.9 p -63.99 -46.78 93.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.1 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.507 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -65.71 -46.76 77.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.06 0.457 . . . . 0.0 110.614 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.816 HG12 HG23 ' A' ' 59' ' ' ILE . 6.3 t -57.0 -44.39 82.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.357 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.4 -38.24 95.41 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.646 -0.788 . . . . 0.0 111.574 179.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.7 -42.92 84.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.973 0.416 . . . . 0.0 110.102 179.232 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.55 ' O ' HD13 ' A' ' 27' ' ' LEU . 1.5 tm? -61.59 -43.73 98.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.105 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.86 -39.54 62.65 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 178.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.83 -36.83 85.59 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.579 178.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.06 -33.1 75.23 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.901 178.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.427 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 2.2 mp -62.74 -52.54 62.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.284 179.331 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.77 -36.1 71.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.329 179.463 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.438 ' O ' HG23 ' A' ' 37' ' ' VAL . 5.0 tptm -59.63 -44.67 93.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.411 179.508 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.839 ' O ' HG23 ' A' ' 38' ' ' VAL . 11.5 m-85 -60.93 -43.22 98.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.509 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -54.24 -46.7 72.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.793 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -58.73 -51.39 70.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.891 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 33' ' ' LYS . 21.7 t -61.32 -40.24 85.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.992 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.876 HG11 HG21 ' A' ' 48' ' ' VAL . 56.2 t -68.0 -39.76 82.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.93 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.5 t -69.12 -25.19 64.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.929 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.21 -32.21 64.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.391 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.746 HD12 ' O ' ' A' ' 42' ' ' LYS . 1.7 pp -96.39 -21.64 17.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.34 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.746 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.1 OUTLIER 60.62 -174.97 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.039 179.862 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.4 t70 70.82 139.14 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.855 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.729 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 60.71 60.35 8.62 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.269 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.485 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 13.9 mmtp -83.68 -46.01 0.79 Allowed Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 111.398 0.147 . . . . 0.0 111.398 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.485 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.9 Cg_exo -53.29 -41.32 73.46 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.322 2.015 . . . . 0.0 112.446 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -67.8 -39.51 83.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.922 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.876 HG21 HG11 ' A' ' 38' ' ' VAL . 33.6 t -70.82 -56.36 11.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.324 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.419 ' O ' ' CG ' ' A' ' 53' ' ' LYS . 15.4 p30 -60.28 -25.33 65.65 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.018 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 7.4 tpp180 -73.55 -43.57 59.58 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.761 0.315 . . . . 0.0 111.405 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.428 ' HA ' ' ND2' ' A' ' 54' ' ' ASN . 3.2 mt-30 -81.31 -44.71 17.26 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.367 0.603 . . . . 0.0 110.0 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.585 HG13 ' O ' ' A' ' 48' ' ' VAL . 2.3 mt -58.09 -40.99 79.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.63 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.474 ' HD3' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -70.5 -50.8 34.04 Favored 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.954 ' HA ' HD12 ' A' ' 57' ' ' ILE . 30.2 p30 -59.68 -25.42 64.73 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.086 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.726 HD22 HD23 ' A' ' 83' ' ' LEU . 50.7 mt -80.02 -43.95 21.01 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.097 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.6 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -56.75 -34.75 67.87 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.412 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.954 HD12 ' HA ' ' A' ' 54' ' ' ASN . 13.3 mt -71.1 -43.5 75.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.1 178.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.696 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.0 OUTLIER -58.53 -47.35 84.46 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.334 179.422 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.816 HG23 HG12 ' A' ' 24' ' ' VAL . 9.9 mt -58.44 -53.04 52.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.717 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -59.4 -33.85 71.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.624 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.62 -50.43 73.18 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.978 0.418 . . . . 0.0 110.316 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.696 HD12 ' O ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -56.32 -54.93 39.6 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.306 179.071 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.497 ' HE1' ' HB ' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -44.89 -57.48 3.75 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.191 -179.87 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.45 -24.87 63.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.957 0.408 . . . . 0.0 110.701 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 24.0 mtpt -82.27 -29.59 31.14 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.577 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -72.79 -35.33 49.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.202 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.01 1.26 57.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.16 -179.101 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.444 ' O ' HG22 ' A' ' 69' ' ' THR . 1.4 m -136.22 21.09 3.2 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.945 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.444 HG22 ' O ' ' A' ' 68' ' ' SER . 1.4 p -160.05 -168.35 2.19 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.949 0.404 . . . . 0.0 110.626 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 5.0 tpt -130.92 37.21 3.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.459 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 33.3 mtp -56.61 139.63 49.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.01 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.8 m -74.53 144.08 44.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.715 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.9 mtt180 -55.04 -30.41 59.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.584 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.88 -44.16 86.5 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.249 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -36.29 79.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.021 179.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.61 ' CD1' HD23 ' A' ' 62' ' ' LEU . 23.0 mm -71.19 -34.06 53.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.368 179.31 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -52.01 67.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.443 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 mppp? -61.91 -46.4 89.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.33 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.417 ' OE1' HD11 ' A' ' 62' ' ' LEU . 2.9 mt-10 -56.43 -33.78 66.17 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.901 ' O ' HG23 ' A' ' 84' ' ' VAL . 12.0 t80 -63.54 -37.47 87.44 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -69.59 -36.2 76.03 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.801 178.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.56 -35.6 74.56 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-O 121.136 0.493 . . . . 0.0 109.728 178.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.726 HD23 HD22 ' A' ' 55' ' ' LEU . 1.6 mt -77.13 -31.58 55.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.062 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.901 HG23 ' O ' ' A' ' 80' ' ' TYR . 41.4 t -71.34 -35.03 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.571 179.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.99 -47.32 52.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.598 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.5 m -69.88 -36.86 75.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.709 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.1 m -65.08 -50.46 66.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.697 179.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -39.35 82.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.647 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -65.83 -31.17 71.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.561 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.516 HD23 HD23 ' A' ' 91' ' ' LEU . 6.2 tt -66.67 -48.19 70.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.697 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.516 HD23 HD23 ' A' ' 90' ' ' LEU . 5.8 mt -64.99 -46.64 80.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.168 0.508 . . . . 0.0 109.89 179.331 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.87 -35.43 70.95 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.636 179.553 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.43 -37.61 77.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.669 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.719 HD22 HD21 ' A' ' 41' ' ' LEU . 2.7 mt -71.42 -43.34 66.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.624 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -54.11 48.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.773 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.3 -34.92 77.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.138 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.525 179.377 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.3 p . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.817 0.342 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 10.9 mt -58.94 -32.77 69.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.006 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.7 t -61.71 -52.28 62.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.041 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -53.0 -41.24 64.46 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.999 0.428 . . . . 0.0 110.745 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.509 ' CG1' HG23 ' A' ' 59' ' ' ILE . 51.4 t -60.78 -49.73 83.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.332 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.19 -37.54 93.09 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.703 -0.76 . . . . 0.0 111.837 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.01 -46.86 82.02 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.912 0.387 . . . . 0.0 110.26 179.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.752 ' CD2' HD13 ' A' ' 83' ' ' LEU . 22.8 tp -62.01 -37.26 84.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.277 -0.419 . . . . 0.0 109.9 179.04 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.68 -38.89 70.23 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -38.65 88.29 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.672 178.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 20.1 mmt180 -59.8 -38.59 82.35 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.136 -0.483 . . . . 0.0 109.975 179.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.731 HD12 ' CD1' ' A' ' 59' ' ' ILE . 5.9 mt -62.5 -48.7 78.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.048 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.02 -38.06 75.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.087 179.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.41 ' HE3' ' CG2' ' A' ' 37' ' ' VAL . 5.2 tptt -58.9 -42.23 89.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.018 179.197 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.882 ' O ' HG23 ' A' ' 38' ' ' VAL . 21.3 m-85 -61.13 -43.95 98.09 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.25 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -54.56 -43.31 71.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.555 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.79 -52.61 64.99 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.393 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.41 ' CG2' ' HE3' ' A' ' 33' ' ' LYS . 24.0 t -59.31 -37.81 71.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.582 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.882 HG23 ' O ' ' A' ' 34' ' ' PHE . 41.0 t -70.07 -31.2 46.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.895 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.42 -27.64 61.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.593 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.35 -34.4 76.03 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.205 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.745 HD12 ' O ' ' A' ' 42' ' ' LYS . 1.8 pp -92.07 -20.19 21.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.245 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.745 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER 59.19 -173.55 0.1 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.866 0.365 . . . . 0.0 110.898 179.767 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 64.57 151.56 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.805 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.491 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 59.8 29.17 66.9 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.306 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.545 ' HZ1' HG12 ' A' ' 38' ' ' VAL . 0.4 OUTLIER -56.2 -57.55 21.91 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 120.494 0.188 . . . . 0.0 111.252 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 11.3 Cg_endo -54.96 -33.88 84.39 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.436 2.09 . . . . 0.0 112.228 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -67.07 -49.06 66.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.705 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.87 HG21 HG11 ' A' ' 38' ' ' VAL . 25.8 t -69.93 -55.17 15.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.95 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.595 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 65.3 m-20 -52.85 -32.87 46.92 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.684 0.278 . . . . 0.0 111.106 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.6 ttt85 -72.15 -46.21 57.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.869 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.45 ' NE2' HD12 ' A' ' 90' ' ' LEU . 9.3 pt20 -73.04 -45.59 56.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.657 0.741 . . . . 0.0 109.472 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.538 HG13 HG12 ' A' ' 48' ' ' VAL . 1.7 mt -57.56 -32.89 43.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.314 178.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.826 ' HD2' HD11 ' A' ' 57' ' ' ILE . 7.1 tmtm? -69.16 -49.8 53.49 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.343 178.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.946 ' HA ' HD12 ' A' ' 57' ' ' ILE . 16.9 m-20 -50.98 -39.84 56.43 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.578 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.674 ' HB3' HD11 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -71.17 -43.01 68.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.182 179.345 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.603 ' HG2' HD13 ' A' ' 31' ' ' LEU . 13.3 mm-40 -57.01 -36.79 70.84 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 178.385 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.946 HD12 ' HA ' ' A' ' 54' ' ' ASN . 12.2 mt -69.63 -42.1 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.173 178.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.655 ' O ' HD12 ' A' ' 62' ' ' LEU . 22.7 t -57.62 -51.52 69.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.192 179.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.731 ' CD1' HD12 ' A' ' 31' ' ' LEU . 5.9 mt -57.92 -46.49 87.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.281 179.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.8 -35.24 75.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.351 179.446 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.92 -49.81 75.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.283 179.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.657 HD23 ' CD1' ' A' ' 76' ' ' ILE . 1.6 mp -55.53 -54.0 49.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.439 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.42 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.15 -54.3 7.02 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.291 -179.907 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.95 -25.22 67.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.863 0.363 . . . . 0.0 110.685 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 25.0 mtpt -82.04 -28.66 32.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.565 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.656 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.7 mm -73.06 -38.06 54.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.43 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.15 -27.57 16.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.715 -179.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.78 ' O ' HG23 ' A' ' 69' ' ' THR . 1.4 m -105.88 25.33 11.03 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.78 HG23 ' O ' ' A' ' 68' ' ' SER . 0.3 OUTLIER 174.14 155.12 0.12 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.878 179.678 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.6 mmt -83.23 82.44 8.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.946 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -84.18 119.03 24.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.054 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.7 m -73.43 144.34 46.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.607 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -52.65 -34.07 49.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.948 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -58.25 -49.09 78.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.47 179.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.32 -34.35 72.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.179 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.843 HG22 ' CE2' ' A' ' 80' ' ' TYR . 21.9 mm -72.4 -34.19 47.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.574 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' ' 80' ' ' TYR . 3.2 tp-100 -60.54 -48.58 81.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.519 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.71 -45.74 85.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.35 179.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.91 -35.99 69.65 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 178.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.918 ' O ' HG23 ' A' ' 84' ' ' VAL . 9.5 m-85 -63.59 -35.08 79.31 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -68.92 -36.76 78.36 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.831 178.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.09 -35.16 76.25 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.261 0.553 . . . . 0.0 109.573 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.752 HD13 ' CD2' ' A' ' 27' ' ' LEU . 1.9 mt -76.56 -31.96 57.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.035 178.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.918 HG23 ' O ' ' A' ' 80' ' ' TYR . 49.3 t -69.15 -34.16 62.02 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.362 179.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.9 mmpt? -72.03 -49.12 39.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.426 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 m -68.27 -37.52 80.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.609 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 98.7 p -67.06 -49.08 66.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.663 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -55.88 -43.96 77.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.975 0.417 . . . . 0.0 110.779 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -67.29 -30.67 70.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.729 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.45 HD12 ' NE2' ' A' ' 51' ' ' GLN . 7.1 tt -63.17 -47.63 81.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.018 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.647 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.4 mt -63.54 -47.2 82.57 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.215 0.531 . . . . 0.0 109.84 179.383 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 49.4 m -58.31 -42.93 87.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.505 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.77 -33.49 75.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.566 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.634 HD11 HG13 ' A' ' 38' ' ' VAL . 11.9 tp -67.59 -49.18 64.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.669 179.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -55.75 -47.0 77.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.597 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.1 pttp -65.34 -28.74 69.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.03 0.443 . . . . 0.0 109.825 178.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt . . . . . 0 C--O 1.231 0.12 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.177 179.786 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.9 p . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.74 0.305 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.487 HD21 ' HB ' ' A' ' 66' ' ' ILE . 3.5 mt -55.11 -32.5 62.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.165 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.5 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.5 p -51.78 -46.99 40.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.36 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.5 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.5 OUTLIER -63.69 -43.83 95.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.14 0.495 . . . . 0.0 110.371 179.687 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.523 ' CG1' HG23 ' A' ' 59' ' ' ILE . 21.1 t -57.61 -44.47 85.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.492 179.357 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.16 -38.57 96.38 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.716 179.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.82 -46.06 81.88 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.079 0.466 . . . . 0.0 110.096 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.871 HD23 HG12 ' A' ' 59' ' ' ILE . 9.5 tp -62.12 -37.19 84.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.883 178.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.56 -38.77 69.76 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.671 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -38.01 84.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.706 178.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -61.22 -37.17 82.07 Favored 'General case' 0 N--CA 1.458 -0.068 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.178 179.336 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.655 HD23 HD11 ' A' ' 59' ' ' ILE . 2.6 mm? -63.91 -52.19 61.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.174 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.04 -32.43 67.97 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.303 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.6 tptt -63.07 -45.13 93.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.326 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.848 ' O ' HG23 ' A' ' 38' ' ' VAL . 13.3 m-85 -60.4 -43.4 96.7 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.59 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -57.33 -42.64 82.31 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.726 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.01 -52.45 65.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.715 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.42 ' O ' HD23 ' A' ' 41' ' ' LEU . 21.7 t -60.95 -37.95 78.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.871 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.924 HG22 HD21 ' A' ' 94' ' ' LEU . 56.1 t -70.09 -32.77 52.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.037 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -72.68 -29.32 63.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.861 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.05 -28.73 64.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.21 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.867 HD12 ' O ' ' A' ' 42' ' ' LYS . 2.2 pp -101.49 -24.25 14.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.202 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.867 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER 60.49 -169.7 0.15 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.816 179.88 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 64.51 136.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.76 -179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.887 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 72.2 26.16 72.84 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.327 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.564 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 1.9 mmtt -56.53 -55.72 39.73 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.52 0.2 . . . . 0.0 111.354 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.564 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 9.8 Cg_endo -53.49 -44.15 51.48 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.348 2.032 . . . . 0.0 112.275 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.88 -49.45 77.41 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.034 0.445 . . . . 0.0 110.511 179.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 44' ' ' GLY . 17.8 t -60.9 -55.28 25.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.756 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.412 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 42.5 m-20 -54.83 -25.61 29.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.115 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -50.41 28.63 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.843 0.354 . . . . 0.0 111.555 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -74.89 -45.17 44.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.496 0.665 . . . . 0.0 109.398 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.699 HG12 HD11 ' A' ' 90' ' ' LEU . 1.5 mt -57.81 -32.35 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.276 178.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.572 ' HG2' HD11 ' A' ' 57' ' ' ILE . 26.9 tttt -69.35 -52.75 24.19 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.429 179.242 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.938 ' HA ' HD12 ' A' ' 57' ' ' ILE . 22.1 m-20 -50.95 -39.3 54.64 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.743 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 1.041 HD13 HD23 ' A' ' 83' ' ' LEU . 0.3 OUTLIER -70.65 -43.68 68.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.283 179.592 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.72 -35.87 69.04 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.53 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.938 HD12 ' HA ' ' A' ' 54' ' ' ASN . 11.9 mt -71.12 -42.56 75.9 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.31 178.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.838 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.1 m -58.89 -49.68 76.88 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.406 179.5 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.871 HG12 HD23 ' A' ' 27' ' ' LEU . 36.0 mt -60.79 -53.49 48.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.552 179.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.84 -34.69 71.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.503 179.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.67 -49.7 75.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.269 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.838 HD12 ' O ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -55.76 -54.67 41.53 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.405 179.186 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.463 ' HE1' ' HB ' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.0 -58.08 3.41 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.218 -179.899 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.17 -24.53 63.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.881 0.372 . . . . 0.0 110.552 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.442 ' O ' HG23 ' A' ' 69' ' ' THR . 0.0 OUTLIER -82.14 -29.44 31.62 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.633 179.496 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.646 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -73.0 -34.84 47.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.278 -179.443 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -87.61 -28.28 22.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.973 -179.163 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.485 ' O ' HG22 ' A' ' 69' ' ' THR . 48.0 t -101.31 17.63 22.1 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.485 HG22 ' O ' ' A' ' 68' ' ' SER . 0.8 OUTLIER -161.46 -168.02 1.89 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.612 179.376 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.83 39.06 3.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.232 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -51.66 152.7 2.68 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.328 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.7 m -86.12 147.41 26.17 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.803 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -30.93 65.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.585 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -46.28 88.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.282 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -60.42 -33.77 73.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.368 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.595 ' CD1' HD23 ' A' ' 62' ' ' LEU . 23.0 mm -71.07 -35.13 57.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.46 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -62.39 -45.46 93.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.562 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.8 tptp -67.01 -49.03 66.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.449 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.541 ' O ' HD12 ' A' ' 83' ' ' LEU . 49.5 mt-10 -56.73 -34.1 67.18 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.919 ' O ' HG23 ' A' ' 84' ' ' VAL . 15.4 t80 -64.8 -35.64 81.73 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.42 -0.955 . . . . 0.0 108.42 177.669 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.52 -36.92 76.86 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.896 178.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.23 -36.87 78.71 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 178.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 1.041 HD23 HD13 ' A' ' 55' ' ' LEU . 1.3 mt -75.75 -31.75 59.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.944 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.919 HG23 ' O ' ' A' ' 80' ' ' TYR . 87.9 t -67.13 -34.17 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.23 179.292 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 16.2 tptt -72.13 -49.36 36.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.095 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.477 ' HB3' HD11 ' A' ' 55' ' ' LEU . 1.1 t -61.78 -40.84 96.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.323 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.7 p -64.41 -48.95 73.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.438 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.91 -44.04 49.93 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.595 179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.18 -29.72 66.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.564 179.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.699 HD11 HG12 ' A' ' 52' ' ' ILE . 9.1 tt -65.43 -48.96 70.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.807 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.492 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.6 mt -62.33 -45.63 92.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.203 0.525 . . . . 0.0 109.665 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 60.3 p -54.79 -42.94 72.4 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.382 179.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.06 -45.23 94.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.43 179.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.924 HD21 HG22 ' A' ' 38' ' ' VAL . 0.5 OUTLIER -54.93 -49.11 72.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.239 179.442 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -56.4 -38.69 71.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.414 179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.62 -32.27 73.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.029 179.14 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.1 mttt . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.249 179.972 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.819 0.343 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -143.85 166.42 27.01 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.529 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -52.58 -61.82 0.44 Allowed 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.551 2.167 . . . . 0.0 112.342 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.6 ' O ' HG12 ' A' ' 22' ' ' VAL . . . 75.94 -90.78 0.88 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.511 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 m -85.21 -24.85 27.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.712 0.291 . . . . 0.0 111.001 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.727 ' HG ' HG21 ' A' ' 66' ' ' ILE . 1.3 mt -55.18 -32.81 62.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.004 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.6 HG12 ' O ' ' A' ' 19' ' ' GLY . 11.3 p -53.33 -46.0 57.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.309 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.501 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -59.66 -46.31 89.43 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.027 0.441 . . . . 0.0 110.537 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.49 ' CG1' HG23 ' A' ' 59' ' ' ILE . 20.6 t -56.92 -43.82 81.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.665 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -63.71 -37.53 94.86 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.644 -0.789 . . . . 0.0 111.891 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.06 -47.94 79.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.895 0.379 . . . . 0.0 110.224 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.623 HD12 ' CE2' ' A' ' 80' ' ' TYR . 0.8 OUTLIER -61.22 -41.02 96.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.072 179.387 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.06 -38.58 62.6 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 mptt -65.85 -40.54 91.8 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.496 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.4 mmt85 -63.06 -33.3 75.15 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.775 178.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.578 HD12 ' CD1' ' A' ' 59' ' ' ILE . 0.4 OUTLIER -62.58 -49.25 75.98 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.218 179.281 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.91 -37.58 74.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.162 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 tptm -59.02 -43.5 91.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.288 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.822 ' O ' HG23 ' A' ' 38' ' ' VAL . 14.1 m-85 -62.47 -40.53 96.96 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.324 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.06 -45.41 79.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.668 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -59.67 -55.27 36.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.575 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 24.1 t -56.08 -38.0 51.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.933 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 1.026 HG11 HG11 ' A' ' 48' ' ' VAL . 49.2 t -75.25 -33.19 27.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.87 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.03 -32.52 73.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.43 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -83.08 -1.79 53.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.537 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.2 mt -89.54 -56.18 3.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.793 0.33 . . . . 0.0 111.006 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.04 3.66 4.45 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.652 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -116.69 138.34 51.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.771 0.32 . . . . 0.0 110.761 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.785 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 58.18 52.05 54.83 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.275 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.506 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 5.8 mmtm -72.05 -43.19 10.32 Favored Pre-proline 0 C--N 1.329 -0.289 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.506 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.5 Cg_exo -53.42 -48.92 19.33 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.226 1.95 . . . . 0.0 112.771 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -65.46 -38.68 90.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.531 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.026 HG11 HG11 ' A' ' 38' ' ' VAL . 25.8 t -72.4 -56.95 8.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.621 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.573 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 28.5 p30 -58.95 -26.17 64.18 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.067 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 54.7 ttm-85 -73.69 -46.37 46.69 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.97 0.414 . . . . 0.0 111.504 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -74.96 -47.44 29.43 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.525 0.679 . . . . 0.0 109.203 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.621 HG13 ' O ' ' A' ' 48' ' ' VAL . 3.7 mt -57.91 -30.92 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.759 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.25 178.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.573 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -70.23 -55.16 9.97 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.594 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.78 ' HA ' HD12 ' A' ' 57' ' ' ILE . 28.2 p30 -59.73 -25.7 65.03 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 120.871 -0.331 . . . . 0.0 111.181 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.845 ' O ' HD12 ' A' ' 59' ' ' ILE . 45.5 mt -77.44 -46.51 22.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.746 0.308 . . . . 0.0 110.226 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.441 ' HG2' HD13 ' A' ' 31' ' ' LEU . 0.5 OUTLIER -56.69 -37.72 71.27 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.634 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.78 HD12 ' HA ' ' A' ' 54' ' ' ASN . 9.7 mt -71.4 -39.93 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.109 178.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.675 ' O ' HD12 ' A' ' 62' ' ' LEU . 16.1 t -57.76 -55.12 38.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.506 179.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.845 HD12 ' O ' ' A' ' 55' ' ' LEU . 2.7 mp -58.87 -47.8 88.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.424 179.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -60.31 -33.95 73.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.352 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.58 -49.5 77.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.327 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.675 HD12 ' O ' ' A' ' 58' ' ' SER . 1.5 mp -55.5 -52.9 62.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.467 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.476 ' HE1' ' HB ' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.25 -54.07 7.51 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.111 179.769 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.45 -24.83 67.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.598 179.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -81.9 -29.11 32.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.336 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.727 HG21 ' HG ' ' A' ' 21' ' ' LEU . 1.9 mm -71.98 -37.63 61.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.031 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.86 -27.96 16.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.571 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.766 ' O ' HG23 ' A' ' 69' ' ' THR . 1.6 t -104.12 24.54 11.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.704 0.288 . . . . 0.0 111.58 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.766 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 175.89 150.05 0.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.823 179.512 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.7 mtt -83.94 72.91 10.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.916 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 8.3 mmm -74.62 138.81 43.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.688 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.2 m -78.06 139.37 39.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.855 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -55.48 -35.02 65.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.665 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -58.27 -44.47 88.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.351 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -61.67 -32.86 73.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.285 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.591 HD13 HD23 ' A' ' 62' ' ' LEU . 22.8 mm -73.1 -36.65 51.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.742 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 37.5 tp60 -60.22 -52.28 65.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.667 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.53 -46.3 86.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.432 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.56 ' CD ' HD21 ' A' ' 62' ' ' LEU . 19.2 mt-10 -56.7 -34.21 67.21 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 178.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.902 ' O ' HG23 ' A' ' 84' ' ' VAL . 36.5 t80 -64.5 -36.28 83.67 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.44 -37.07 77.22 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.89 178.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.58 -36.07 75.52 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.257 0.551 . . . . 0.0 109.642 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 20.9 mt -76.1 -31.66 58.8 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.066 178.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.902 HG23 ' O ' ' A' ' 80' ' ' TYR . 51.1 t -69.41 -34.43 62.26 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.518 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 18.2 mmtt -71.98 -49.18 39.47 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.357 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.572 ' HB3' HD21 ' A' ' 55' ' ' LEU . 0.3 OUTLIER -67.68 -42.28 82.37 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.463 179.532 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.411 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 72.6 m -65.08 -47.2 78.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.475 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -54.3 -44.67 72.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.623 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.64 -35.03 79.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.61 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.426 HD23 HD23 ' A' ' 91' ' ' LEU . 5.3 tt -60.24 -45.91 91.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.849 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.426 HD23 HD23 ' A' ' 90' ' ' LEU . 7.1 mt -61.58 -51.95 66.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.069 0.462 . . . . 0.0 109.809 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.1 m -56.11 -41.28 75.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.353 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.21 -40.51 90.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.547 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 1.007 HD21 HG22 ' A' ' 38' ' ' VAL . 5.4 mp -63.85 -44.14 94.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.417 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.435 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 5.4 mp0 -55.85 -50.63 70.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.679 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 16.3 pttp -62.39 -28.65 69.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.101 0.477 . . . . 0.0 109.782 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.33 -55.77 9.47 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.417 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.435 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 0.0 OUTLIER -61.88 -47.6 84.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.185 -179.352 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.49 -31.38 72.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.821 0.344 . . . . 0.0 110.925 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -68.14 -39.87 82.57 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.728 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 58.9 28.69 17.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.991 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -160.9 130.57 4.92 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.873 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.259 179.99 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.912 0.387 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -74.85 146.42 35.19 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.507 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -54.21 129.33 33.95 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.47 2.113 . . . . 0.0 112.345 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.575 ' O ' HG12 ' A' ' 22' ' ' VAL . . . -123.83 -90.44 0.92 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.473 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.514 ' O ' HG23 ' A' ' 24' ' ' VAL . 0.2 OUTLIER -76.16 -19.21 58.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.647 0.26 . . . . 0.0 111.104 179.858 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.2 mp -53.89 -32.71 54.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.129 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.575 HG12 ' O ' ' A' ' 19' ' ' GLY . 10.8 p -55.35 -49.68 71.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.268 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.536 ' N ' HG13 ' A' ' 22' ' ' VAL . 35.3 mttt -68.92 -43.91 74.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.897 0.379 . . . . 0.0 110.48 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 20' ' ' SER . 21.0 t -57.12 -40.18 71.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.286 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.53 -39.73 94.04 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.679 -0.772 . . . . 0.0 111.614 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -32.52 72.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.896 0.379 . . . . 0.0 110.087 179.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.686 HD13 HD13 ' A' ' 83' ' ' LEU . 0.3 OUTLIER -68.1 -49.9 58.25 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.772 179.137 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -52.99 -33.39 51.27 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.96 -39.3 79.56 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.416 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.445 ' HG3' ' CZ ' ' A' ' 34' ' ' PHE . 2.0 tpt180 -64.12 -31.97 73.36 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.442 ' CD1' HD12 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -65.96 -46.25 78.79 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.066 179.097 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -58.06 -37.37 74.3 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.859 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -59.75 -49.78 76.4 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.949 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.743 ' O ' HG23 ' A' ' 38' ' ' VAL . 11.3 m-85 -60.82 -37.87 83.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.38 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 27.3 m-80 -58.4 -43.54 88.61 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.411 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.41 -51.15 71.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.147 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 36.8 t -57.46 -37.71 59.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.333 179.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.842 ' HA ' HD12 ' A' ' 41' ' ' LEU . 95.5 t -68.57 -41.84 83.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.639 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.8 t -58.17 -34.35 70.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.672 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -86.5 -16.15 37.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.326 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.842 HD12 ' HA ' ' A' ' 38' ' ' VAL . 12.4 mt -74.53 -50.67 17.21 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.167 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 0.1 OUTLIER 67.19 10.47 7.74 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.716 -179.706 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -131.4 152.92 50.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.729 0.299 . . . . 0.0 110.908 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 56.47 33.11 61.68 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.359 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.535 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 17.8 mmtt -53.54 -57.1 18.58 Favored Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 111.53 0.196 . . . . 0.0 111.53 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 14.2 Cg_endo -57.41 -41.76 68.94 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.391 2.061 . . . . 0.0 113.004 -179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -64.96 -50.77 65.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.841 0.353 . . . . 0.0 111.509 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.539 ' O ' HG13 ' A' ' 52' ' ' ILE . 8.4 p -69.2 -49.74 58.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.703 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.521 ' N ' HG13 ' A' ' 48' ' ' VAL . 44.8 p30 -61.83 -25.14 67.33 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.105 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.438 ' N ' ' OD1' ' A' ' 49' ' ' ASN . 1.0 OUTLIER -73.47 -47.76 38.85 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.808 0.337 . . . . 0.0 111.097 179.875 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -74.76 -46.62 35.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.509 0.671 . . . . 0.0 109.382 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.898 HD11 HD11 ' A' ' 90' ' ' LEU . 1.4 mt -57.27 -32.57 41.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 CA-C-N 114.801 -1.09 . . . . 0.0 110.299 178.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 9.0 tttt -69.29 -53.26 20.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.348 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.93 ' HA ' HD12 ' A' ' 57' ' ' ILE . 9.4 m-20 -53.78 -29.22 39.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.83 0.348 . . . . 0.0 110.861 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.89 HD12 ' HA ' ' A' ' 52' ' ' ILE . 4.1 mt -77.16 -47.92 19.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.243 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' A' ' 57' ' ' ILE . 0.0 OUTLIER -56.39 -31.3 63.71 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 178.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.93 HD12 ' HA ' ' A' ' 54' ' ' ASN . 14.8 mt -71.6 -43.57 71.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.107 178.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.747 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.2 m -58.35 -53.14 61.69 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.772 179.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.442 HD12 ' CD1' ' A' ' 31' ' ' LEU . 23.0 mt -57.04 -52.43 56.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.791 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.4 -33.79 68.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.306 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -58.63 -49.35 77.82 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.107 179.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.747 HD12 ' O ' ' A' ' 58' ' ' SER . 1.9 mp -55.34 -53.22 58.96 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.446 179.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.461 ' HE3' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.4 -53.05 9.19 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.042 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.4 ' O ' ' CB ' ' A' ' 68' ' ' SER . . . -63.27 -25.09 68.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.653 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 26.4 mtpt -82.03 -28.87 32.25 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.132 0.491 . . . . 0.0 110.641 179.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.653 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.0 mm -71.49 -41.84 72.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.394 -179.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.66 -29.12 16.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.799 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.782 ' O ' HG23 ' A' ' 69' ' ' THR . 0.3 OUTLIER -101.41 21.8 13.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.527 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.782 HG23 ' O ' ' A' ' 68' ' ' SER . 0.5 OUTLIER 178.05 155.88 0.38 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.93 179.502 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.97 81.65 4.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.801 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.4 mmm -86.68 141.44 28.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.948 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.8 m -77.96 139.89 39.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.924 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -53.99 -31.99 52.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.95 0.405 . . . . 0.0 110.878 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -59.3 -49.09 79.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.535 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -61.87 -32.3 72.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.44 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.584 ' CD1' HD23 ' A' ' 62' ' ' LEU . 20.5 mm -71.75 -33.94 50.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.74 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -46.6 76.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.926 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 21.8 mmtt -63.4 -51.25 66.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.75 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -56.3 -33.71 65.82 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.923 ' O ' HG23 ' A' ' 84' ' ' VAL . 2.9 t80 -64.44 -36.19 83.37 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.36 -36.65 77.06 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.959 178.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.91 -39.13 80.58 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 121.285 0.565 . . . . 0.0 109.644 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.686 HD13 HD13 ' A' ' 27' ' ' LEU . 2.1 mt -75.13 -29.49 60.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.095 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.923 HG23 ' O ' ' A' ' 80' ' ' TYR . 64.0 t -71.04 -37.4 67.35 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.269 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -49.31 64.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.181 179.397 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.589 ' HB3' HD21 ' A' ' 55' ' ' LEU . 0.2 OUTLIER -67.03 -35.52 80.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.145 179.287 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.435 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 7.3 t -65.69 -46.84 77.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.439 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.588 ' OE1' HG12 ' A' ' 84' ' ' VAL . 25.8 mt-10 -56.13 -47.24 78.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.117 0.484 . . . . 0.0 110.649 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.44 -31.37 72.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.735 179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.898 HD11 HD11 ' A' ' 52' ' ' ILE . 4.6 tt -63.99 -42.2 97.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.954 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.4 mt -64.6 -50.34 67.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.201 0.524 . . . . 0.0 110.016 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.6 m -59.08 -39.18 81.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.838 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.4 -53.27 17.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.098 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.494 HD21 HG22 ' A' ' 38' ' ' VAL . 7.1 mp -58.33 -33.59 69.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.024 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.499 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -66.98 -51.78 50.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.851 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.424 ' HA ' ' CG ' ' A' ' 99' ' ' GLN . 10.0 pttp -57.53 -28.46 63.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.188 0.518 . . . . 0.0 110.078 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.8 mttp -67.95 -58.59 4.29 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.946 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 0.0 OUTLIER -61.28 -42.19 98.22 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.933 -178.779 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . 0.424 ' CG ' ' HA ' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -65.03 -35.55 81.54 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.126 -0.23 . . . . 0.0 111.344 -179.524 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -75.23 -53.54 8.62 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.736 0.303 . . . . 0.0 110.813 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 46.82 -170.13 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.196 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -85.11 -52.83 5.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.651 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.914 179.855 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.851 0.357 . . . . 0.0 111.066 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.414 ' N ' ' HD3' ' A' ' 18' ' ' PRO . . . 57.79 61.9 6.93 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.771 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.414 ' HD3' ' N ' ' A' ' 17' ' ' GLY . 39.4 Cg_exo -60.22 -50.19 7.79 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.634 2.223 . . . . 0.0 112.075 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.93 89.1 1.46 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.477 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 86.2 p -177.94 -38.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.807 0.337 . . . . 0.0 110.843 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.453 HD21 ' HB ' ' A' ' 66' ' ' ILE . 27.9 mt -54.83 -32.89 61.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.945 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.491 HG13 ' N ' ' A' ' 23' ' ' LYS . 12.3 p -59.11 -45.65 92.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.228 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.491 ' N ' HG13 ' A' ' 22' ' ' VAL . 8.0 mmtt -57.98 -44.59 87.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.059 0.457 . . . . 0.0 110.661 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.44 HG12 ' CG2' ' A' ' 59' ' ' ILE . 14.9 t -56.81 -44.93 82.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.612 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.73 -37.45 94.29 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.721 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.1 m -57.01 -47.27 81.24 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.993 0.425 . . . . 0.0 110.35 179.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.64 HD13 ' CE2' ' A' ' 80' ' ' TYR . 5.1 tp -60.74 -41.4 95.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.166 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -54.37 -36.82 64.29 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.96 -38.71 86.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.681 178.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 mpt_? -63.18 -34.87 78.58 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.89 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.55 HD12 HD12 ' A' ' 59' ' ' ILE . 13.2 mt -63.17 -49.71 73.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.197 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.99 -36.86 73.24 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.11 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.0 tptm -59.32 -44.36 92.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.236 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.815 ' O ' HG23 ' A' ' 38' ' ' VAL . 7.6 m-85 -62.57 -37.59 86.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.165 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -58.71 -41.6 86.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.439 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.86 -55.15 32.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.495 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.6 t -55.83 -37.87 49.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.573 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 1.024 HG21 HG11 ' A' ' 48' ' ' VAL . 61.1 t -74.22 -35.07 39.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.519 179.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -35.3 71.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.196 179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.2 -31.0 68.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.838 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.681 HD13 ' HB2' ' A' ' 98' ' ' LYS . 1.3 pp -117.31 80.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.743 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.74 -27.64 5.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.245 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -58.64 98.9 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.877 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.555 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 95.66 40.45 4.14 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.5 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.451 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -71.58 -49.98 10.81 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.605 0.24 . . . . 0.0 111.181 -179.952 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.451 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.1 Cg_exo -53.28 -40.36 77.98 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.427 2.085 . . . . 0.0 112.657 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -59.93 -50.56 73.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.02 0.438 . . . . 0.0 110.817 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.024 HG11 HG21 ' A' ' 38' ' ' VAL . 4.0 t -66.2 -55.32 19.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.749 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.583 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 83.9 m-20 -52.92 -27.86 20.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.049 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 48.8 ttt-85 -71.75 -53.4 13.55 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.916 0.388 . . . . 0.0 111.899 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.4 ' HA ' HD21 ' A' ' 54' ' ' ASN . 6.0 mt-30 -69.74 -43.84 71.47 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.786 0.803 . . . . 0.0 109.082 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.601 HG13 HG12 ' A' ' 48' ' ' VAL . 1.4 mt -59.52 -29.99 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.869 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.212 178.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.583 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -69.94 -55.11 10.51 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.403 179.717 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.899 ' HA ' HD12 ' A' ' 57' ' ' ILE . 27.5 p30 -60.19 -25.7 65.78 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.917 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.487 HD22 HD23 ' A' ' 83' ' ' LEU . 19.4 mt -79.84 -39.07 31.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.731 0.3 . . . . 0.0 110.198 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.73 -36.39 82.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 178.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.899 HD12 ' HA ' ' A' ' 54' ' ' ASN . 10.2 mt -69.93 -39.23 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.94 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.733 ' O ' HD12 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -57.37 -45.87 83.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.128 179.407 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.55 HD12 HD12 ' A' ' 31' ' ' LEU . 64.0 mt -61.52 -51.1 76.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.127 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -58.98 -33.59 70.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.094 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -57.53 -49.42 76.39 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.885 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.733 HD12 ' O ' ' A' ' 58' ' ' SER . 1.1 mp -55.23 -51.58 66.14 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.108 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.457 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.35 -54.79 6.75 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.97 179.819 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.47 -25.18 67.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.641 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.439 ' O ' HG23 ' A' ' 69' ' ' THR . 50.8 mtmt -82.13 -29.49 31.63 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 121.105 0.478 . . . . 0.0 110.483 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.8 mm -70.84 -36.53 64.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.939 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.2 mmmm -94.85 1.23 55.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.93 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.454 ' O ' HG22 ' A' ' 69' ' ' THR . 10.1 m -134.12 21.25 3.76 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.454 HG22 ' O ' ' A' ' 68' ' ' SER . 1.4 p -160.22 -167.6 1.97 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.565 179.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.5 mtm -125.37 33.13 5.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.492 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.1 mtp -58.04 123.69 16.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.091 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.0 m -67.58 145.57 54.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.742 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -55.15 -30.82 60.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.652 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -59.0 -45.55 90.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.314 179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -33.95 72.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.094 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.592 ' CD1' HD23 ' A' ' 62' ' ' LEU . 18.3 mm -72.96 -33.95 44.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.425 179.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.22 -46.2 91.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.564 179.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -66.37 -48.54 69.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.467 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.552 ' O ' HD12 ' A' ' 83' ' ' LEU . 5.1 mt-10 -56.57 -33.99 66.7 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.861 ' O ' HG23 ' A' ' 84' ' ' VAL . 9.3 t80 -64.35 -36.52 84.39 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.71 -37.45 76.56 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.963 178.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.29 -34.07 73.24 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 121.203 0.525 . . . . 0.0 109.803 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.631 HD13 ' CD2' ' A' ' 27' ' ' LEU . 1.3 mt -76.78 -31.44 57.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.04 178.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.861 HG23 ' O ' ' A' ' 80' ' ' TYR . 56.7 t -68.59 -36.83 76.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.537 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.02 -49.15 39.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.564 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.76 -41.16 92.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.625 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.415 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 43.1 m -63.62 -50.35 69.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.574 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.58 -42.85 68.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.728 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -69.92 -27.05 64.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.81 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.508 HD23 HD23 ' A' ' 91' ' ' LEU . 5.5 tt -69.83 -49.11 55.73 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.017 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.565 HD21 ' CD1' ' A' ' 34' ' ' PHE . 7.2 mt -62.32 -50.9 69.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.123 0.487 . . . . 0.0 109.916 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.7 m -56.38 -34.2 66.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.725 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.18 -53.13 21.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.272 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.676 HD22 HG22 ' A' ' 38' ' ' VAL . 2.8 pp -68.63 -28.84 67.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.103 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.443 ' HB2' ' O ' ' A' ' 91' ' ' LEU . 10.0 tt0 -63.87 -54.13 39.68 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.864 0.364 . . . . 0.0 110.492 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -67.14 -29.52 69.25 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.58 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.03 -32.38 65.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.922 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.681 ' HB2' HD13 ' A' ' 41' ' ' LEU . 0.6 OUTLIER -76.44 -42.32 44.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.753 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -68.88 -37.96 79.38 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.805 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -78.51 -38.4 40.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.015 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 62.73 -84.48 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.753 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 58.47 17.45 4.89 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.499 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 . . . . . 0 C--N 1.328 -0.343 0 CA-C-O 120.812 0.339 . . . . 0.0 110.979 -179.841 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.846 0.355 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.2 -167.88 47.89 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.579 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.89 77.67 1.1 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.678 2.252 . . . . 0.0 112.235 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -122.87 45.52 1.19 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.442 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.445 ' O ' HG23 ' A' ' 24' ' ' VAL . 0.3 OUTLIER -177.26 -39.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.903 0.382 . . . . 0.0 110.866 179.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.441 ' HG ' HG21 ' A' ' 66' ' ' ILE . 1.6 mp -58.57 -32.99 69.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.975 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.521 HG13 ' N ' ' A' ' 23' ' ' LYS . 9.8 p -60.51 -47.63 91.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.335 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.521 ' N ' HG13 ' A' ' 22' ' ' VAL . 12.5 mttm -59.81 -49.93 75.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.081 0.467 . . . . 0.0 110.349 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.657 HG12 HG23 ' A' ' 59' ' ' ILE . 10.7 t -56.85 -40.79 73.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.256 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -64.54 -37.57 94.59 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.479 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -56.86 -43.75 81.52 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.131 0.491 . . . . 0.0 109.897 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.87 HD12 HD11 ' A' ' 59' ' ' ILE . 0.2 OUTLIER -63.36 -40.15 96.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.732 178.909 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.9 tptt -53.82 -36.91 63.01 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.04 -42.63 84.48 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.675 178.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.55 -31.19 72.28 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.851 178.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.951 HD22 HD12 ' A' ' 59' ' ' ILE . 1.7 tp -63.58 -50.9 67.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.163 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.21 -34.44 72.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.176 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -45.27 94.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.312 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.882 ' O ' HG23 ' A' ' 38' ' ' VAL . 7.7 m-85 -60.38 -44.1 95.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.232 179.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -57.24 -37.28 72.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.58 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -61.17 -55.15 35.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.362 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 39.5 t -57.82 -37.61 61.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.368 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.882 HG23 ' O ' ' A' ' 34' ' ' PHE . 47.5 t -67.34 -43.7 87.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.853 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 m -55.81 -39.57 71.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.723 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.71 -27.74 68.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.031 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.776 HD22 ' HB3' ' A' ' 98' ' ' LYS . 44.2 mt -70.66 -40.27 73.11 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.999 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 63.61 14.16 7.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.41 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -138.42 158.45 44.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.688 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.769 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 58.7 30.53 65.88 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.27 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.612 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 1.6 mmtp -54.65 -52.08 73.12 Favored Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.612 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 11.0 Cg_endo -55.03 -49.28 17.13 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.447 2.098 . . . . 0.0 113.316 -179.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -59.66 -50.27 74.53 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.54 0.21 . . . . 0.0 111.436 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.769 HG23 ' O ' ' A' ' 44' ' ' GLY . 2.7 t -66.23 -55.39 19.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 120.841 0.353 . . . . 0.0 110.668 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.635 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 73.9 m-20 -52.7 -29.99 29.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.204 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -49.84 38.61 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.497 ' HB2' HD12 ' A' ' 90' ' ' LEU . 39.6 mt-30 -71.33 -45.96 61.73 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 179.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.749 ' CD1' HG12 ' A' ' 48' ' ' VAL . 3.6 mt -57.13 -30.4 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.461 178.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.893 ' CD ' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -69.12 -50.87 44.06 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 178.634 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.918 ' HA ' HD12 ' A' ' 57' ' ' ILE . 14.7 m-20 -51.29 -38.69 54.21 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.385 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 27.9 mt -70.92 -43.4 68.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.084 179.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.82 ' HG2' HD23 ' A' ' 31' ' ' LEU . 1.6 mm-40 -56.65 -36.91 70.06 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.918 HD12 ' HA ' ' A' ' 54' ' ' ASN . 10.2 mt -70.98 -41.75 76.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.188 178.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.889 ' O ' HD12 ' A' ' 62' ' ' LEU . 29.7 t -58.53 -52.1 67.07 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.519 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.951 HD12 HD22 ' A' ' 31' ' ' LEU . 36.8 mt -61.5 -52.64 58.73 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.661 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.422 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 1.4 t70 -56.55 -34.84 67.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.311 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.79 -49.22 78.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.852 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.889 HD12 ' O ' ' A' ' 58' ' ' SER . 1.3 mp -55.62 -56.56 18.87 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.041 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.428 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.73 -54.44 7.89 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.762 0.315 . . . . 0.0 110.841 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.12 -24.44 66.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.918 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.481 ' O ' HG23 ' A' ' 69' ' ' THR . 10.1 mtmt -82.2 -30.06 31.09 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.223 0.535 . . . . 0.0 110.57 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.648 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -72.29 -33.74 47.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.983 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.0 mmtt -89.53 -24.11 21.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.051 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.548 ' O ' HG22 ' A' ' 69' ' ' THR . 58.3 m -115.38 19.08 15.74 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.548 HG22 ' O ' ' A' ' 68' ' ' SER . 0.1 OUTLIER -163.08 166.46 23.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.588 179.196 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -107.3 43.72 1.15 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.567 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -53.71 142.18 24.17 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.174 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.4 m -79.22 148.97 32.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.774 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.77 -31.15 68.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.594 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -59.22 -45.39 91.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.443 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -34.33 75.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.421 179.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.675 ' CD1' HD23 ' A' ' 62' ' ' LEU . 23.3 mm -71.49 -33.96 51.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.72 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -63.88 -51.75 63.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.783 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -60.94 -47.09 88.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.743 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -56.44 -33.17 65.6 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.877 ' O ' HG23 ' A' ' 84' ' ' VAL . 4.6 t80 -64.32 -37.71 88.46 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 177.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -69.9 -37.67 76.05 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.15 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.32 -33.54 72.53 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 121.114 0.483 . . . . 0.0 109.873 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.691 HD12 ' HA ' ' A' ' 80' ' ' TYR . 4.7 mt -77.77 -30.96 51.7 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.05 178.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.877 HG23 ' O ' ' A' ' 80' ' ' TYR . 52.7 t -69.42 -38.19 76.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.746 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.408 ' O ' ' HG2' ' A' ' 88' ' ' GLU . 0.8 OUTLIER -72.34 -46.93 53.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.732 179.761 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 m -68.94 -36.6 78.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.941 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.509 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 58.9 m -69.94 -51.12 35.36 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.039 -179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 12.2 pt-20 -55.39 -42.95 74.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.947 0.403 . . . . 0.0 110.797 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.402 ' N ' ' HG3' ' A' ' 88' ' ' GLU . 37.8 t70 -71.31 -28.23 63.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.849 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.786 HD23 HD23 ' A' ' 91' ' ' LEU . 1.5 tt -68.22 -50.21 55.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.297 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.786 HD23 HD23 ' A' ' 90' ' ' LEU . 5.8 mt -63.76 -41.57 97.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.361 0.6 . . . . 0.0 109.715 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.7 m -56.55 -39.79 74.01 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.767 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.417 ' O ' ' HG3' ' A' ' 97' ' ' LYS . . . -66.83 -54.32 23.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.344 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.417 ' CD2' ' O ' ' A' ' 90' ' ' LEU . 0.3 OUTLIER -63.88 -25.93 68.38 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.798 179.83 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -40.03 77.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.96 0.409 . . . . 0.0 110.128 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.1 mtpt -64.14 -43.52 94.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.012 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.417 ' HG3' ' O ' ' A' ' 93' ' ' ALA . 12.9 mttm -57.18 -47.34 81.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.952 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.776 ' HB3' HD22 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -75.78 -28.96 58.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.059 -179.801 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -70.83 -41.8 71.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.752 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -78.09 -28.99 48.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.107 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -90.7 46.24 1.32 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.147 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -161.94 -64.88 0.05 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.689 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.655 179.669 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.888 0.375 . . . . 0.0 110.995 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -177.62 56.56 0.1 OUTLIER Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.577 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.655 ' HA ' HD12 ' A' ' 21' ' ' LEU . 72.6 Cg_endo -76.39 -177.77 3.96 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.686 2.257 . . . . 0.0 112.433 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 112.38 -43.48 1.71 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.616 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.7 t -104.25 -20.67 13.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.689 0.28 . . . . 0.0 111.183 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.689 ' HG ' HG21 ' A' ' 66' ' ' ILE . 0.7 OUTLIER -54.84 -32.91 61.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.206 -179.914 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.5 t -61.97 -52.57 58.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.173 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.69 -45.53 63.52 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.936 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.567 ' CG1' HG23 ' A' ' 59' ' ' ILE . 30.6 t -60.1 -48.53 87.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.719 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.76 -39.71 98.29 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.011 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.1 m -56.7 -42.15 78.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.022 0.439 . . . . 0.0 110.236 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.744 HD23 HD13 ' A' ' 83' ' ' LEU . 20.1 tp -64.71 -41.35 96.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.145 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.7 ttmm -52.81 -39.35 62.32 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -65.05 -42.37 94.32 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.423 178.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.36 -31.6 72.8 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.824 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.629 HD21 HG22 ' A' ' 52' ' ' ILE . 3.3 tt -61.97 -50.37 72.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.068 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -57.74 -38.83 76.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.164 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -57.89 -44.59 86.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.251 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.785 ' O ' HG23 ' A' ' 38' ' ' VAL . 23.5 m-85 -59.71 -43.19 94.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.394 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -56.48 -40.61 75.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.397 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.88 -52.07 66.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.278 179.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 38.2 t -59.76 -37.79 73.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.497 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.892 HG22 HD21 ' A' ' 94' ' ' LEU . 60.3 t -67.47 -43.86 87.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.802 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.8 m -61.95 -29.22 70.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.443 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.28 -31.43 71.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.845 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.599 ' O ' HD12 ' A' ' 41' ' ' LEU . 1.3 pp -113.84 79.1 1.21 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.026 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 43' ' ' ASP . 6.4 mmtp -46.55 99.23 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.91 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' A' ' 42' ' ' LYS . 33.9 t0 178.22 146.62 0.14 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.919 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.625 ' O ' HG12 ' A' ' 48' ' ' VAL . . . 50.79 42.2 45.42 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.706 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.58 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 7.8 mmtp -59.39 -51.62 80.06 Favored Pre-proline 0 C--N 1.329 -0.303 0 N-CA-C 111.799 0.296 . . . . 0.0 111.799 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.58 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 28.9 Cg_endo -63.78 -42.52 19.75 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.201 1.934 . . . . 0.0 112.943 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -65.15 -50.55 65.54 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.823 0.344 . . . . 0.0 111.193 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.625 HG12 ' O ' ' A' ' 44' ' ' GLY . 14.5 p -63.51 -55.23 24.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.598 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.592 ' HA ' HG13 ' A' ' 52' ' ' ILE . 60.3 m-20 -51.58 -31.2 23.8 Favored 'General case' 0 N--CA 1.461 0.116 0 CA-C-O 120.867 0.365 . . . . 0.0 110.702 179.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.09 -44.77 83.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.322 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -70.95 -48.7 51.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.269 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.698 ' HA ' HD12 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -57.46 -41.1 78.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.031 179.442 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.564 ' HD3' HD11 ' A' ' 57' ' ' ILE . 1.1 tttt -58.36 -52.43 65.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.684 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.899 ' HA ' HD12 ' A' ' 57' ' ' ILE . 11.0 m-20 -52.04 -39.81 60.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.944 0.402 . . . . 0.0 110.512 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.88 HD21 ' HB3' ' A' ' 86' ' ' SER . 10.5 mt -68.39 -44.44 75.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.594 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.65 -36.38 69.46 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.899 HD12 ' HA ' ' A' ' 54' ' ' ASN . 10.5 mt -71.35 -42.48 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.289 178.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.746 ' O ' HD12 ' A' ' 62' ' ' LEU . 2.8 m -60.4 -52.23 66.13 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.566 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.567 HG23 ' CG1' ' A' ' 24' ' ' VAL . 6.9 mt -58.13 -50.43 78.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.86 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -59.33 -37.16 77.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.813 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.66 -50.0 74.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.997 0.427 . . . . 0.0 110.676 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.746 HD12 ' O ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -55.72 -55.44 32.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.547 179.372 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.431 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -44.9 -54.61 6.27 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.263 -179.848 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.78 -25.93 66.9 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.678 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.55 ' HA ' HG23 ' A' ' 69' ' ' THR . 3.6 mtmp? -82.11 -29.49 31.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.024 0.44 . . . . 0.0 110.697 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.689 HG21 ' HG ' ' A' ' 21' ' ' LEU . 1.3 mm -73.12 -33.94 43.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.28 -179.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 14.3 mmtm -93.03 1.02 57.48 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.514 ' O ' HG22 ' A' ' 69' ' ' THR . 17.0 m -147.23 21.76 1.21 Allowed 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.55 HG23 ' HA ' ' A' ' 65' ' ' LYS . 0.2 OUTLIER -161.85 158.6 25.75 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.752 179.362 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -97.39 43.52 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.318 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.4 129.13 21.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.341 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.427 HG22 ' H ' ' A' ' 74' ' ' GLU . 12.4 m -71.36 137.83 48.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.578 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.84 -30.29 22.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.717 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.427 ' H ' HG22 ' A' ' 72' ' ' THR . 1.1 tt0 -59.34 -43.92 92.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.377 179.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 15.1 tp60 -68.05 -33.97 75.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.417 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.655 ' CD1' HD23 ' A' ' 62' ' ' LEU . 22.8 mm -69.58 -39.46 78.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.498 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -41.35 96.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.669 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.25 -48.24 68.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.453 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -56.57 -34.25 66.96 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.858 ' O ' HG23 ' A' ' 84' ' ' VAL . 52.5 t80 -65.04 -36.81 85.55 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.407 -0.961 . . . . 0.0 108.407 177.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -69.84 -37.62 76.24 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.775 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.94 -33.61 72.13 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.744 HD13 HD23 ' A' ' 27' ' ' LEU . 2.0 mt -76.88 -32.39 57.44 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.105 179.007 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.858 HG23 ' O ' ' A' ' 80' ' ' TYR . 43.2 t -69.52 -36.66 72.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.495 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.404 ' O ' ' HG3' ' A' ' 88' ' ' GLU . 4.4 mmtm -72.13 -42.66 65.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.566 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.88 ' HB3' HD21 ' A' ' 55' ' ' LEU . 0.3 OUTLIER -73.91 -35.65 64.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.492 179.587 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.431 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 34.8 m -68.59 -50.61 50.32 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.645 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 85' ' ' LYS . 1.6 pp20? -60.19 -38.7 84.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.323 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -65.85 -32.86 74.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.235 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.535 HD23 ' C ' ' A' ' 90' ' ' LEU . 5.7 tt -64.66 -44.07 91.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.667 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.0 mt -62.09 -43.54 98.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.789 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 57.9 m -54.66 -46.68 74.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.449 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.3 -40.71 97.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.415 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.892 HD21 HG22 ' A' ' 38' ' ' VAL . 1.3 mp -57.72 -49.75 75.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.56 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.83 -42.33 75.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.592 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.13 -38.6 80.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.571 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.47 ' HA ' ' HG2' ' A' ' 100' ' ' GLN . 7.2 mttt -62.13 -46.12 90.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.371 0.605 . . . . 0.0 111.069 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -65.06 -53.55 43.98 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.661 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -63.73 -32.14 73.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.055 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.47 ' HG2' ' HA ' ' A' ' 97' ' ' LYS . 3.8 pt20 -79.65 -39.75 30.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.77 0.319 . . . . 0.0 111.185 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -68.88 -56.85 6.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.026 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 61.04 116.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.881 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.337 -179.646 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.83 0.348 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 122.38 164.58 12.21 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.532 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.35 138.81 36.78 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.699 2.266 . . . . 0.0 112.302 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -176.16 44.91 0.11 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.308 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.2 p -178.28 -38.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.872 0.368 . . . . 0.0 110.829 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.5 ' HG ' HG21 ' A' ' 66' ' ' ILE . 13.6 mt -54.6 -32.76 59.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.95 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.504 HG13 ' N ' ' A' ' 23' ' ' LYS . 9.9 p -59.13 -47.06 91.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.022 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.504 ' N ' HG13 ' A' ' 22' ' ' VAL . 5.6 tttt -61.54 -41.98 98.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.077 0.465 . . . . 0.0 110.3 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.564 ' CG1' HG23 ' A' ' 59' ' ' ILE . 40.8 t -57.03 -44.88 83.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.49 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.17 -37.69 94.92 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.711 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.44 -44.57 84.82 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.895 0.378 . . . . 0.0 110.222 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.679 HD23 HD13 ' A' ' 83' ' ' LEU . 20.0 tp -62.65 -41.79 99.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.088 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.3 tptt -53.28 -38.5 63.15 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.9 mptt -65.15 -40.67 94.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.32 178.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.453 ' HD3' HD12 ' A' ' 27' ' ' LEU . 60.8 mtp180 -63.44 -31.32 72.45 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.739 178.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.518 HD13 ' CD1' ' A' ' 59' ' ' ILE . 0.2 OUTLIER -63.09 -49.09 75.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.103 179.143 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -59.48 -37.0 77.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.315 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -50.24 73.56 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.332 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.89 ' O ' HG23 ' A' ' 38' ' ' VAL . 4.1 m-85 -58.78 -45.51 89.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.619 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -51.56 -43.8 62.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.02 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -61.43 -53.92 50.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.566 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 33.5 t -58.63 -37.7 66.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.767 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 1.116 HG22 HD21 ' A' ' 94' ' ' LEU . 39.3 t -71.08 -40.46 75.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.081 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.44 -38.39 77.39 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.86 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.32 -20.05 63.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.436 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.85 HD12 ' HA ' ' A' ' 38' ' ' VAL . 44.4 mt -75.33 -42.48 54.29 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.211 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.61 14.0 7.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.439 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -131.68 146.53 52.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.704 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.712 ' O ' HG12 ' A' ' 48' ' ' VAL . . . 57.22 27.93 58.22 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.334 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.799 ' HE3' HG12 ' A' ' 38' ' ' VAL . 0.6 OUTLIER -61.92 -49.33 86.08 Favored Pre-proline 0 C--N 1.329 -0.313 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.716 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.633 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 10.8 Cg_endo -55.0 -45.48 40.59 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.146 1.897 . . . . 0.0 112.954 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 50' ' ' ARG . 11.8 pt-20 -70.06 -50.73 38.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.768 0.318 . . . . 0.0 111.479 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.712 HG12 ' O ' ' A' ' 44' ' ' GLY . 8.3 p -62.04 -55.29 25.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.718 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.572 ' HA ' HG13 ' A' ' 52' ' ' ILE . 98.2 m-20 -51.59 -43.79 62.58 Favored 'General case' 0 N--CA 1.463 0.204 0 O-C-N 123.078 0.236 . . . . 0.0 111.399 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.514 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -60.78 -36.04 77.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.773 0.32 . . . . 0.0 110.682 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.514 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 44.6 mt-30 -74.42 -48.57 26.87 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.219 0.533 . . . . 0.0 109.973 179.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.861 ' HA ' HD12 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -57.56 -38.86 66.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.923 179.319 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.411 ' O ' HG13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -61.45 -53.2 59.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.597 179.507 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.922 ' HA ' HD12 ' A' ' 57' ' ' ILE . 17.6 m-20 -51.54 -36.52 45.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.786 0.327 . . . . 0.0 110.724 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.861 HD12 ' HA ' ' A' ' 52' ' ' ILE . 2.7 mt -72.93 -45.54 57.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.82 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.772 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.4 OUTLIER -56.74 -33.11 66.23 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.779 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.922 HD12 ' HA ' ' A' ' 54' ' ' ASN . 14.5 mt -71.26 -44.19 73.51 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.188 178.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.721 ' O ' HD12 ' A' ' 62' ' ' LEU . 8.1 m -59.11 -46.67 87.71 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.377 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.772 HD12 ' HA ' ' A' ' 56' ' ' GLU . 5.7 mt -58.46 -55.07 24.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.732 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -57.9 -33.73 69.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.543 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.84 -49.97 74.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.206 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.721 HD12 ' O ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -55.89 -54.64 42.14 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.264 179.045 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.426 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.03 -54.95 6.04 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.255 179.914 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.27 -25.17 66.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.649 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 24.1 mtpt -82.29 -29.97 30.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.166 0.508 . . . . 0.0 110.62 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -71.99 -34.06 49.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.092 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.64 1.16 55.56 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.238 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.45 ' O ' HG22 ' A' ' 69' ' ' THR . 58.3 m -138.87 21.91 2.65 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.45 HG22 ' O ' ' A' ' 68' ' ' SER . 1.3 p -160.16 179.61 8.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.869 0.366 . . . . 0.0 110.73 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.58 37.36 3.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.565 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 16.7 mmm -56.0 146.18 23.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.125 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.2 m -84.97 142.41 29.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.755 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.99 -29.81 57.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.707 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -46.39 89.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.451 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.46 -34.23 75.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.436 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.639 ' CD1' HD23 ' A' ' 62' ' ' LEU . 27.0 mm -70.58 -33.87 55.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.77 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 8.4 tp60 -66.46 -42.65 87.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.872 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.59 -50.9 56.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.72 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -56.37 -34.09 66.33 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.916 ' O ' HG23 ' A' ' 84' ' ' VAL . 64.9 t80 -64.55 -35.65 81.66 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -69.55 -37.52 77.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.963 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.25 -37.27 77.15 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.313 0.578 . . . . 0.0 109.589 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.679 HD13 HD23 ' A' ' 27' ' ' LEU . 26.3 mt -75.51 -30.71 59.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.101 178.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.916 HG23 ' O ' ' A' ' 80' ' ' TYR . 61.7 t -69.17 -34.57 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.53 179.347 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.16 -49.11 38.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.464 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 m -68.1 -36.85 80.45 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.568 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.0 t -66.64 -50.33 63.3 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.811 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.4 ' HG3' ' N ' ' A' ' 89' ' ' ASP . 8.7 pt-20 -58.79 -36.0 73.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.487 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.4 ' N ' ' HG3' ' A' ' 88' ' ' GLU . 0.8 OUTLIER -70.19 -31.42 68.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.73 179.649 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.414 HD23 HD23 ' A' ' 91' ' ' LEU . 6.5 tt -66.34 -49.05 68.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.993 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.678 HD21 ' CE1' ' A' ' 34' ' ' PHE . 7.0 mt -60.71 -49.09 78.89 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.143 0.497 . . . . 0.0 109.848 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.2 m -55.73 -42.72 75.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.662 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.77 -52.25 63.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.685 179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 1.116 HD21 HG22 ' A' ' 38' ' ' VAL . 4.6 mp -57.45 -42.68 82.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.756 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.414 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 0.3 OUTLIER -55.59 -43.88 76.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.611 179.717 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.7 mtmt -66.35 -29.64 69.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.031 0.443 . . . . 0.0 109.835 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -71.29 -53.2 15.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.458 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.453 ' HD2' HD21 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -61.19 -45.57 94.05 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.152 -179.54 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . 0.406 ' HG3' ' N ' ' A' ' 100' ' ' GLN . 19.2 pt20 -59.44 -42.54 92.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.743 0.306 . . . . 0.0 110.69 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.406 ' N ' ' HG3' ' A' ' 99' ' ' GLN . 57.3 mt-30 -69.72 -36.03 75.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.504 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 45.29 27.65 0.37 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.834 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 61.07 116.9 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.043 0.449 . . . . 0.0 111.036 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 . . . . . 0 C--N 1.321 -0.644 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.441 -179.825 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.873 0.368 . . . . 0.0 110.996 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.45 -101.72 1.9 Allowed Glycine 0 CA--C 1.519 0.331 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.614 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.73 163.0 39.7 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.495 2.13 . . . . 0.0 112.339 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.422 ' O ' HG12 ' A' ' 22' ' ' VAL . . . 139.64 -69.92 0.47 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.587 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.4 p -93.12 -25.05 18.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.769 0.319 . . . . 0.0 111.14 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.455 HD23 ' HA ' ' A' ' 63' ' ' MET . 2.9 mt -54.69 -32.89 60.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.161 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.501 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.0 p -63.98 -46.5 93.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.412 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.501 ' N ' HG13 ' A' ' 22' ' ' VAL . 47.8 mttm -56.73 -50.52 71.96 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.019 0.438 . . . . 0.0 110.674 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 1.034 HG12 HG23 ' A' ' 59' ' ' ILE . 3.5 t -57.04 -39.96 69.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.116 179.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.1 -37.15 93.81 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.595 179.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.1 m -57.02 -47.28 81.28 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.078 0.466 . . . . 0.0 110.084 179.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.497 HD11 ' HB2' ' A' ' 83' ' ' LEU . 4.1 tt -61.53 -38.7 88.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.818 179.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.463 ' HB2' HG21 ' A' ' 59' ' ' ILE . 6.5 tttt -54.92 -37.8 66.84 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 178.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.0 -41.85 95.0 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.33 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.26 -30.48 71.62 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.795 178.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.555 HD13 ' CD1' ' A' ' 59' ' ' ILE . 0.3 OUTLIER -63.0 -52.35 63.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.101 179.312 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -57.93 -36.06 71.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.076 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.417 ' O ' HG23 ' A' ' 37' ' ' VAL . 0.1 OUTLIER -58.99 -44.55 91.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.244 179.305 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.857 ' O ' HG23 ' A' ' 38' ' ' VAL . 13.1 m-85 -61.18 -43.37 98.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.346 179.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.8 m-20 -54.09 -44.67 71.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.534 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -59.26 -54.32 48.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.062 0.458 . . . . 0.0 110.439 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 33' ' ' LYS . 22.4 t -55.89 -37.78 49.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.49 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.857 HG23 ' O ' ' A' ' 34' ' ' PHE . 48.8 t -69.58 -40.86 80.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.618 179.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.8 t -63.72 -23.29 67.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.334 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.05 -38.75 92.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.564 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.605 HD21 ' HA ' ' A' ' 38' ' ' VAL . 0.5 OUTLIER -88.81 -34.23 17.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.682 0.277 . . . . 0.0 111.23 -179.836 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.86 10.02 6.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.756 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.432 ' H ' HD12 ' A' ' 41' ' ' LEU . 5.1 t0 -103.76 103.28 13.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.78 0.324 . . . . 0.0 111.071 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.715 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 101.11 53.67 1.0 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.575 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.52 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 2.2 mmtt -66.69 -57.27 12.28 Favored Pre-proline 0 C--N 1.327 -0.388 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 13.8 Cg_endo -56.88 -49.47 14.39 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.47 2.113 . . . . 0.0 112.974 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.27 -50.14 72.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.826 0.346 . . . . 0.0 111.213 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.765 HG11 HG11 ' A' ' 38' ' ' VAL . 50.7 t -64.59 -55.57 20.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.706 179.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.446 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 85.3 m-20 -55.46 -25.57 37.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.092 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.32 -49.44 34.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.861 0.362 . . . . 0.0 111.585 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -76.62 -44.56 33.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.492 0.663 . . . . 0.0 109.753 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.767 ' HA ' HD12 ' A' ' 55' ' ' LEU . 1.8 mt -57.62 -35.34 50.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.337 179.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.504 ' HG3' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -69.4 -51.71 33.91 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.591 179.283 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.94 ' HA ' HD12 ' A' ' 57' ' ' ILE . 16.4 m-20 -50.99 -34.46 29.2 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.712 0.291 . . . . 0.0 110.513 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.767 HD12 ' HA ' ' A' ' 52' ' ' ILE . 1.7 mt -75.81 -43.49 45.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.315 179.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.832 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -56.86 -36.41 70.01 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.551 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.94 HD12 ' HA ' ' A' ' 54' ' ' ASN . 12.2 mt -68.51 -40.73 82.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 114.937 -1.028 . . . . 0.0 109.946 178.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.74 ' O ' HD12 ' A' ' 62' ' ' LEU . 9.8 m -57.48 -45.62 84.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.482 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 1.034 HG23 HG12 ' A' ' 24' ' ' VAL . 4.6 mt -60.23 -50.72 79.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.398 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.436 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 72.7 m-20 -57.08 -31.68 65.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.166 179.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -63.25 -49.32 74.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.672 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.74 HD12 ' O ' ' A' ' 58' ' ' SER . 1.6 mp -56.16 -56.99 14.17 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.023 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.455 ' HA ' HD23 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -46.44 -50.72 16.4 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.7 0.286 . . . . 0.0 110.841 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.07 -24.44 67.7 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.753 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.9 mtpt -82.45 -29.36 30.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.113 0.482 . . . . 0.0 110.557 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.654 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -73.07 -37.13 52.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.201 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 5.5 mmmt -93.96 -27.46 16.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.542 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.767 ' O ' HG23 ' A' ' 69' ' ' THR . 1.2 t -105.67 24.96 11.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.699 0.285 . . . . 0.0 111.411 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.767 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 174.66 155.06 0.14 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.887 179.746 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 5.9 mtm -107.73 69.27 0.73 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.907 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.64 ' SD ' HD11 ' A' ' 76' ' ' ILE . 9.2 ptm -72.11 173.29 8.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.791 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.43 141.96 28.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.066 -179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.08 -29.89 67.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.714 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -58.01 -40.25 80.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.725 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -35.04 79.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.52 179.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.663 ' CD1' HD23 ' A' ' 62' ' ' LEU . 27.0 mm -67.96 -37.54 78.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.833 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 4.0 tp60 -66.68 -52.12 48.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.853 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -45.67 85.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.731 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -56.56 -35.13 67.81 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.912 ' O ' HG23 ' A' ' 84' ' ' VAL . 11.2 t80 -64.21 -38.08 89.76 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 177.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -69.97 -35.79 74.72 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.09 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.28 -39.42 79.2 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.242 0.544 . . . . 0.0 109.75 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.497 ' HB2' HD11 ' A' ' 27' ' ' LEU . 6.5 mt -74.45 -31.25 62.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.045 178.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.912 HG23 ' O ' ' A' ' 80' ' ' TYR . 61.4 t -69.57 -38.99 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.356 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -66.13 -49.14 68.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.377 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 74.7 m -68.27 -38.06 81.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.407 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.437 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 24.3 m -65.7 -50.37 65.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.692 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.89 -43.58 73.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.985 0.421 . . . . 0.0 110.728 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -67.56 -29.12 68.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.707 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.494 HD23 HD23 ' A' ' 91' ' ' LEU . 6.1 tt -67.92 -48.89 64.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.064 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.617 HD21 ' CD1' ' A' ' 34' ' ' PHE . 7.0 mt -61.03 -52.44 64.94 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.057 0.456 . . . . 0.0 110.076 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.4 m -58.58 -38.32 77.66 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.662 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.25 -36.06 76.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.875 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.511 HD21 HG13 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -70.23 -42.42 72.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.856 179.904 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.47 ' HA ' ' HD3' ' A' ' 98' ' ' LYS . 0.1 OUTLIER -59.01 -54.25 49.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.686 179.825 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.6 mtpp -63.78 -28.9 70.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.37 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.5 tttp -67.14 -34.57 77.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.161 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.47 ' HD3' ' HA ' ' A' ' 95' ' ' GLN . 0.2 OUTLIER -74.95 -53.87 8.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.887 0.375 . . . . 0.0 111.104 -179.901 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.68 -26.37 67.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.557 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -78.88 -53.05 7.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.096 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 58.92 -86.23 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.57 -179.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -158.72 98.57 1.51 Allowed 'General case' 0 CA--C 1.52 -0.173 0 CA-C-O 120.979 0.419 . . . . 0.0 110.549 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 C--N 1.323 -0.567 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.598 179.573 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 . . . . . 0 N--CA 1.457 -0.085 0 CA-C-O 120.873 0.368 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -156.94 -177.89 30.49 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.543 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.19 -167.73 0.26 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.591 2.194 . . . . 0.0 112.338 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.79 -42.46 1.91 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.376 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.583 ' OG ' HG21 ' A' ' 76' ' ' ILE . 40.2 t -109.74 -35.28 6.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.831 0.348 . . . . 0.0 110.799 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.5 -32.73 72.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.933 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.517 HG13 ' N ' ' A' ' 23' ' ' LYS . 11.5 p -61.18 -47.98 91.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.254 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.517 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -59.45 -37.91 79.36 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.912 0.387 . . . . 0.0 110.589 179.666 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 20' ' ' SER . 19.8 t -58.67 -50.61 78.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.395 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.15 -40.45 97.23 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.644 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.644 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -57.02 -37.99 72.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.08 0.466 . . . . 0.0 110.022 179.292 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.818 HD22 HD13 ' A' ' 83' ' ' LEU . 0.7 OUTLIER -64.97 -42.83 94.23 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 178.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.75 -35.78 56.74 Favored 'General case' 0 C--N 1.333 -0.128 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.644 ' HG3' ' HA ' ' A' ' 26' ' ' THR . 23.2 mttt -61.69 -45.64 93.1 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.592 178.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -36.96 71.55 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.316 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.402 HD23 ' HB3' ' A' ' 56' ' ' GLU . 6.1 mp -61.36 -51.2 69.8 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.491 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -57.94 -37.04 73.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.296 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.434 ' O ' HG23 ' A' ' 37' ' ' VAL . 3.8 tptt -58.86 -43.2 90.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.263 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.814 ' O ' HG23 ' A' ' 38' ' ' VAL . 13.0 m-85 -63.91 -41.39 97.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.612 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 45.5 m-20 -55.19 -44.19 75.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.872 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -62.72 -54.29 41.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.766 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 33' ' ' LYS . 33.7 t -57.71 -38.22 63.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.06 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.891 HG21 HG11 ' A' ' 48' ' ' VAL . 47.9 t -75.07 -35.45 34.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.885 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.4 p -60.78 -34.02 73.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.531 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.11 -21.42 59.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.269 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' A' ' 38' ' ' VAL . 77.5 mt -71.45 -41.28 69.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.93 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.67 13.81 7.66 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.567 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -131.06 135.56 47.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.92 0.391 . . . . 0.0 110.898 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.549 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 59.05 57.27 20.73 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.488 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.498 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 3.7 mmmm -77.45 -45.09 2.62 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 120.508 0.194 . . . . 0.0 111.348 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.498 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 50.2 Cg_exo -53.68 -42.36 66.75 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.256 1.971 . . . . 0.0 112.475 -179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -60.64 -50.23 74.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.921 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.891 HG11 HG21 ' A' ' 38' ' ' VAL . 5.1 t -65.92 -55.21 20.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.082 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.6 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 97.4 m-20 -52.85 -31.11 37.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.362 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 26.4 ttm180 -73.06 -47.89 40.74 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -73.01 -41.27 64.44 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.621 0.724 . . . . 0.0 109.41 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.618 HG13 HG12 ' A' ' 48' ' ' VAL . 1.4 mt -61.87 -31.54 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.082 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.6 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -70.16 -55.05 10.35 Favored 'General case' 0 N--CA 1.46 0.055 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.366 179.54 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.961 ' HA ' HD12 ' A' ' 57' ' ' ILE . 28.5 p30 -59.83 -25.42 64.98 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.989 -179.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 71.9 mt -77.54 -46.74 21.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.514 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.541 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -57.0 -32.88 66.57 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.957 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.961 HD12 ' HA ' ' A' ' 54' ' ' ASN . 13.6 mt -71.4 -41.43 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.063 178.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.558 ' O ' HD12 ' A' ' 62' ' ' LEU . 69.1 m -57.46 -47.6 81.42 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.214 179.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.541 HD12 ' HA ' ' A' ' 56' ' ' GLU . 11.7 mt -59.78 -49.83 82.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.271 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.79 -32.58 71.92 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.114 179.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -57.83 -49.86 75.22 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.96 179.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.642 ' O ' HG12 ' A' ' 66' ' ' ILE . 0.8 OUTLIER -55.72 -53.62 54.41 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.2 178.89 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.432 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.28 -56.44 4.87 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.018 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.62 -24.07 65.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.607 179.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.07 -29.19 31.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.233 0.539 . . . . 0.0 110.415 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.642 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.8 mm -73.46 -41.11 56.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.499 -179.302 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.75 -29.51 16.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.875 -179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.765 ' O ' HG23 ' A' ' 69' ' ' THR . 0.8 OUTLIER -102.32 24.23 10.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.693 0.282 . . . . 0.0 111.713 -179.387 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.765 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 177.57 149.82 0.18 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.935 179.523 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.4 mtm -76.06 63.22 1.77 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.957 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.51 125.77 25.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.788 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.1 m -78.11 135.54 37.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.799 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.86 -33.71 50.98 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.871 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.39 -47.51 83.64 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.347 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.15 -32.92 74.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.353 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.629 ' CD1' HD23 ' A' ' 62' ' ' LEU . 26.1 mm -71.58 -38.69 68.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.695 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -52.18 66.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.634 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.58 -47.04 80.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.485 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -56.54 -34.06 66.71 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.907 ' O ' HG23 ' A' ' 84' ' ' VAL . 16.2 t80 -64.24 -37.26 86.86 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -69.67 -36.7 76.26 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.978 178.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.49 -36.07 75.34 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.146 0.498 . . . . 0.0 109.688 179.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.818 HD13 HD22 ' A' ' 27' ' ' LEU . 5.2 mt -76.74 -31.25 56.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.004 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.907 HG23 ' O ' ' A' ' 80' ' ' TYR . 54.0 t -69.55 -34.83 63.49 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.466 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.8 tptp -71.99 -49.26 38.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.408 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 11.6 m -66.71 -43.7 83.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.406 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 98.5 p -61.51 -48.46 80.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.505 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -55.28 -41.04 71.73 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.702 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.98 -34.36 78.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.602 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 tt -63.36 -46.3 87.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.791 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.765 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.3 mt -63.75 -47.47 80.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.129 0.49 . . . . 0.0 109.825 179.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 33.8 p -56.52 -39.51 73.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.564 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.99 -47.03 75.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.592 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 85.7 mt -57.2 -44.78 83.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.632 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.421 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -59.82 -39.85 86.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.368 179.46 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.4 mttt -64.22 -29.15 70.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.853 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.4 -58.46 3.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.309 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 0.0 OUTLIER -58.26 -48.01 81.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.314 -179.45 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -60.15 -38.06 81.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.843 0.354 . . . . 0.0 110.771 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -62.64 -37.4 86.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.745 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -132.21 96.88 3.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.874 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -67.59 -26.32 66.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.043 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.361 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 . . . . . 0 C--O 1.233 0.216 0 CA-C-O 120.823 0.344 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 167.03 -95.01 0.11 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.422 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.58 -167.87 0.36 Allowed 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.519 2.146 . . . . 0.0 112.262 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.531 ' O ' HG12 ' A' ' 22' ' ' VAL . . . 104.27 -41.21 2.2 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.519 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 p -87.83 -23.19 24.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.84 0.352 . . . . 0.0 111.178 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.471 ' HG ' HG21 ' A' ' 66' ' ' ILE . 20.4 mt -54.01 -33.0 55.96 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.074 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.531 HG12 ' O ' ' A' ' 19' ' ' GLY . 12.3 p -60.78 -45.91 97.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.042 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.501 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -60.44 -46.81 88.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.058 0.456 . . . . 0.0 110.587 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.535 HG13 HG23 ' A' ' 59' ' ' ILE . 19.4 t -56.97 -44.78 83.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.419 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.89 -36.41 92.78 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.707 -0.759 . . . . 0.0 111.68 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.3 m -57.98 -47.51 82.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.913 0.387 . . . . 0.0 110.186 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.768 HD13 HD13 ' A' ' 83' ' ' LEU . 12.8 mt -60.84 -39.04 87.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.078 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.483 ' HA ' HD12 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -54.55 -40.62 68.88 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.589 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.57 -37.23 86.84 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.387 178.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.405 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -62.04 -33.4 74.3 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.726 178.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 1.006 HD11 HD12 ' A' ' 59' ' ' ILE . 64.4 mt -65.26 -48.86 71.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.022 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -57.75 -42.06 83.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.195 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.4 tptt -61.08 -41.93 97.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.047 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.829 ' CZ ' HD21 ' A' ' 91' ' ' LEU . 4.0 m-30 -60.73 -45.44 94.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.366 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 12.6 m-20 -58.65 -36.45 74.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.615 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -61.42 -55.29 32.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.479 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 36.6 t -58.97 -37.93 70.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.67 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.87 HG21 HG11 ' A' ' 48' ' ' VAL . 46.3 t -70.82 -37.79 70.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.871 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.56 -36.88 79.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.426 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.34 -12.77 60.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.387 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.532 HD12 ' HA ' ' A' ' 38' ' ' VAL . 52.3 mt -85.98 -55.52 3.91 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.965 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.13 3.73 4.44 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.649 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -114.09 126.64 55.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.781 0.324 . . . . 0.0 110.692 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.772 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 75.89 31.93 54.59 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.326 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.535 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 6.8 mmtt -48.1 -57.31 10.72 Favored Pre-proline 0 C--N 1.331 -0.236 0 N-CA-C 111.606 0.224 . . . . 0.0 111.606 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 10.6 Cg_endo -54.1 -49.19 17.9 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.524 2.149 . . . . 0.0 112.513 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -53.34 -49.71 66.55 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.017 0.437 . . . . 0.0 111.264 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.87 HG11 HG21 ' A' ' 38' ' ' VAL . 2.5 t -67.64 -55.23 17.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.92 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.567 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 79.5 m-20 -52.66 -35.7 55.48 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.494 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 11.6 ptt85 -73.65 -38.96 64.82 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.494 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 61.7 mt-30 -75.94 -47.75 23.95 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.731 0.777 . . . . 0.0 109.163 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.727 ' CD1' HG12 ' A' ' 48' ' ' VAL . 3.6 mt -57.03 -32.14 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 114.555 -1.202 . . . . 0.0 110.09 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.613 ' HD2' HD11 ' A' ' 57' ' ' ILE . 0.4 OUTLIER -69.13 -52.99 22.54 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.418 179.011 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.919 ' HA ' HD12 ' A' ' 57' ' ' ILE . 13.1 m-20 -50.99 -34.31 28.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.875 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 51' ' ' GLN . 26.4 mt -76.0 -45.96 31.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.96 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.451 ' HG3' ' N ' ' A' ' 57' ' ' ILE . 0.4 OUTLIER -56.65 -31.91 64.83 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.915 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.919 HD12 ' HA ' ' A' ' 54' ' ' ASN . 16.8 mt -71.34 -44.79 72.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.055 178.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.603 ' O ' HD12 ' A' ' 62' ' ' LEU . 4.6 m -60.27 -52.41 65.39 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.355 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 1.006 HD12 HD11 ' A' ' 31' ' ' LEU . 71.6 mt -58.24 -51.43 71.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.585 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.16 -33.52 71.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.206 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -57.64 -49.49 76.28 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.962 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.657 ' O ' HG12 ' A' ' 66' ' ' ILE . 0.8 OUTLIER -55.33 -52.51 63.24 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.16 178.912 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.502 ' HE3' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -44.96 -58.55 3.08 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.02 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.24 -24.2 62.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.576 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.434 ' HA ' HG23 ' A' ' 69' ' ' THR . 0.2 OUTLIER -82.18 -29.66 31.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.141 0.496 . . . . 0.0 110.562 179.485 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.2 mm -70.49 -40.45 77.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.237 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.27 1.23 51.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.17 -179.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.478 ' O ' HG22 ' A' ' 69' ' ' THR . 1.5 m -132.95 21.18 4.13 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 120.748 -0.381 . . . . 0.0 112.018 -179.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.478 HG22 ' O ' ' A' ' 68' ' ' SER . 1.0 OUTLIER -160.34 -175.34 4.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.858 0.361 . . . . 0.0 110.833 179.32 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -126.55 33.42 4.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.392 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.1 mmm -56.91 149.98 17.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.999 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.7 m -80.67 143.94 32.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.904 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.81 -30.77 58.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.64 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -58.08 -46.26 85.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.39 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.06 -35.68 73.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.203 179.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.646 HG22 ' CE2' ' A' ' 80' ' ' TYR . 18.4 mm -69.54 -33.97 59.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.489 179.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 80' ' ' TYR . 8.0 tp-100 -61.83 -49.44 76.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.468 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 mmtt -62.59 -41.61 99.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.273 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -57.69 -36.22 71.67 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.905 ' O ' HG23 ' A' ' 84' ' ' VAL . 14.5 m-85 -64.32 -35.9 82.38 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 177.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -69.44 -37.58 77.43 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.026 178.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.46 -34.62 75.76 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.24 0.543 . . . . 0.0 109.61 178.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.768 HD13 HD13 ' A' ' 27' ' ' LEU . 54.4 mt -76.87 -30.26 56.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.06 178.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.905 HG23 ' O ' ' A' ' 80' ' ' TYR . 66.4 t -68.12 -35.76 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.41 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.7 tptt -72.44 -49.26 34.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.599 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.9 m -66.03 -43.11 88.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.518 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 96.3 p -62.38 -46.7 87.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.525 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -55.94 -41.26 74.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.634 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.96 -32.12 73.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.704 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.589 HD22 ' CD2' ' A' ' 34' ' ' PHE . 7.9 tt -63.97 -47.8 78.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.046 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.829 HD21 ' CZ ' ' A' ' 34' ' ' PHE . 7.6 mt -60.59 -52.55 64.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.109 0.481 . . . . 0.0 109.925 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 69.8 m -54.93 -38.63 67.91 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.487 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.435 ' HA ' ' HG2' ' A' ' 96' ' ' LYS . . . -68.93 -36.17 77.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.621 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.9 tp -66.29 -49.06 68.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.745 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.459 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 75.6 mm-40 -55.92 -48.92 74.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.613 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.435 ' HG2' ' HA ' ' A' ' 93' ' ' ALA . 9.0 pttt -62.84 -28.62 70.14 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.89 -55.39 13.02 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.599 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 0.1 OUTLIER -62.28 -44.08 97.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.605 -179.067 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . 0.416 ' HG2' ' HA ' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -66.42 -31.02 71.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.573 0.225 . . . . 0.0 111.065 -179.698 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -78.15 -52.67 8.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.778 0.323 . . . . 0.0 110.765 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -74.68 79.8 2.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.789 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -145.64 -47.0 0.21 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.933 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.929 179.93 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.903 0.382 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.93 108.82 1.2 Allowed Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.616 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.98 77.19 1.17 Allowed 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.406 2.071 . . . . 0.0 112.22 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -124.64 7.75 8.34 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.926 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.553 ' HB3' HG21 ' A' ' 76' ' ' ILE . 1.0 OUTLIER -112.29 -28.83 7.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.738 0.304 . . . . 0.0 111.025 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.778 ' HG ' HG21 ' A' ' 66' ' ' ILE . 5.0 mt -53.78 -32.84 53.97 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.061 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.49 HG13 ' N ' ' A' ' 23' ' ' LYS . 11.6 p -67.8 -45.15 84.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.97 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.49 ' N ' HG13 ' A' ' 22' ' ' VAL . 2.0 tppp? -63.43 -52.98 59.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.928 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.757 HG12 HG23 ' A' ' 59' ' ' ILE . 23.7 t -56.76 -46.97 83.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.578 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -58.83 -40.22 94.84 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.511 -0.852 . . . . 0.0 111.419 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.469 HG22 ' HE ' ' A' ' 30' ' ' ARG . 48.4 m -57.18 -38.96 74.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.063 0.459 . . . . 0.0 109.925 179.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.702 ' CD2' HD13 ' A' ' 83' ' ' LEU . 15.8 tp -62.84 -44.06 97.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.878 179.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.95 -39.6 63.03 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -36.2 83.55 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.582 178.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.469 ' HE ' HG22 ' A' ' 26' ' ' THR . 0.0 OUTLIER -65.62 -33.61 76.3 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.876 179.024 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.726 HD13 ' CD1' ' A' ' 59' ' ' ILE . 0.7 OUTLIER -64.96 -42.02 94.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.945 179.194 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.28 -49.39 77.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.832 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.5 ' O ' HG23 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -57.86 -35.78 71.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.823 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.829 ' O ' HG23 ' A' ' 38' ' ' VAL . 15.7 m-85 -65.62 -39.87 91.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.891 0.376 . . . . 0.0 110.411 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -61.33 -40.61 94.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.379 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -53.66 54.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.363 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 33' ' ' LYS . 22.6 t -57.54 -37.96 61.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.723 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.829 HG23 ' O ' ' A' ' 34' ' ' PHE . 77.2 t -71.18 -39.41 73.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.892 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.84 -37.16 75.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.74 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.76 -17.98 65.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.426 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.63 HD12 ' HA ' ' A' ' 38' ' ' VAL . 24.4 mt -79.93 -34.64 38.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.148 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER 64.77 12.69 7.87 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.476 -179.741 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -133.82 155.28 50.11 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.814 0.34 . . . . 0.0 110.766 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.854 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 57.8 27.79 59.6 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.32 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.524 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 1.1 mmtt -55.73 -57.21 22.69 Favored Pre-proline 0 C--N 1.329 -0.306 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 11.7 Cg_endo -55.69 -49.09 16.96 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.428 2.085 . . . . 0.0 112.68 -179.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 4.2 mt-10 -55.49 -48.95 73.78 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.069 0.461 . . . . 0.0 111.074 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.854 HG23 ' O ' ' A' ' 44' ' ' GLY . 18.8 t -67.19 -50.06 66.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.256 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.416 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 86.0 m-20 -59.06 -33.09 70.38 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.493 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 8.1 ptp180 -73.51 -40.21 64.21 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.442 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.493 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 31.7 mt-30 -75.98 -49.77 16.74 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.05 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.591 HG13 ' O ' ' A' ' 48' ' ' VAL . 2.0 mt -56.89 -29.91 32.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.005 178.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.473 ' HA ' ' HG2' ' A' ' 56' ' ' GLU . 32.2 tttt -69.26 -53.17 21.16 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.159 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.933 ' HA ' HD12 ' A' ' 57' ' ' ILE . 8.4 m-20 -53.17 -32.39 47.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.843 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.563 ' HB2' HD21 ' A' ' 31' ' ' LEU . 55.6 mt -74.51 -47.82 30.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.305 -179.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.473 ' HG2' ' HA ' ' A' ' 53' ' ' LYS . 3.5 pt-20 -56.21 -31.79 63.8 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.933 HD12 ' HA ' ' A' ' 54' ' ' ASN . 15.6 mt -71.04 -43.26 76.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.897 178.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.825 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.5 m -58.48 -46.96 85.57 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.255 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.757 HG23 HG12 ' A' ' 24' ' ' VAL . 55.5 mt -60.08 -55.56 23.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.458 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.2 -34.12 68.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.245 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 58' ' ' SER . . . -56.8 -49.17 76.14 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.197 0.522 . . . . 0.0 109.899 179.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.825 HD12 ' O ' ' A' ' 58' ' ' SER . 1.2 mp -55.09 -48.77 73.1 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.867 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.409 ' CE ' ' HB ' ' A' ' 24' ' ' VAL . 12.5 mmt -44.85 -59.84 2.34 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.764 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.94 -23.58 61.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.589 179.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.405 ' O ' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -82.03 -29.0 32.19 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.293 0.568 . . . . 0.0 110.538 179.37 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.778 HG21 ' HG ' ' A' ' 21' ' ' LEU . 2.3 mm -73.41 -45.7 51.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.913 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.3 -32.43 17.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.013 -178.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.806 ' O ' HG23 ' A' ' 69' ' ' THR . 0.3 OUTLIER -98.08 22.18 9.78 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.233 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.806 HG23 ' O ' ' A' ' 68' ' ' SER . 0.6 OUTLIER 179.36 149.75 0.29 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.817 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -78.9 61.2 3.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.951 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.07 120.59 10.57 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.806 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.2 m -65.32 132.71 49.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.774 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.34 -31.51 54.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.83 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -61.33 -45.75 93.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.437 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.42 -33.72 75.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.424 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.625 ' CD1' HD23 ' A' ' 62' ' ' LEU . 20.9 mm -68.53 -33.88 62.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.787 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -67.8 -48.69 65.58 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.856 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -49.02 70.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.578 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -56.61 -33.54 66.35 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 178.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.824 ' O ' HG23 ' A' ' 84' ' ' VAL . 54.8 t80 -64.89 -35.62 81.73 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 177.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -69.54 -37.05 76.92 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.93 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.5 -35.38 75.8 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-O 121.28 0.562 . . . . 0.0 109.633 178.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.702 HD13 ' CD2' ' A' ' 27' ' ' LEU . 7.1 mt -75.51 -31.57 60.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.082 178.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.824 HG23 ' O ' ' A' ' 80' ' ' TYR . 75.6 t -67.71 -34.64 69.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.386 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? -72.15 -49.42 36.01 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.277 179.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 69.6 m -63.4 -41.67 98.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.18 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.1 t -62.94 -50.0 72.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.321 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -50.59 -42.37 55.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.564 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -70.64 -29.17 65.46 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.636 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.566 HD11 HG12 ' A' ' 52' ' ' ILE . 7.0 tt -67.86 -49.23 63.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.948 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.45 ' CD2' ' CE1' ' A' ' 34' ' ' PHE . 6.8 mt -61.78 -46.64 88.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.128 0.49 . . . . 0.0 109.797 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 12.1 p -54.94 -42.52 72.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.452 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.84 -47.33 81.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.348 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.495 ' CD2' HG22 ' A' ' 38' ' ' VAL . 4.2 mt -59.03 -45.15 91.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.439 179.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.4 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 2.5 mp0 -55.83 -39.39 71.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.333 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.12 -30.84 70.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.818 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 43.6 mttt -68.5 -54.0 19.61 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.958 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 0.0 OUTLIER -65.54 -37.18 85.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.876 0.37 . . . . 0.0 110.786 179.859 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -59.43 -42.35 91.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.658 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -78.0 -48.98 14.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.711 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -67.1 -172.59 0.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.777 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -70.7 132.28 45.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.903 0.383 . . . . 0.0 110.784 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.139 179.768 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 40.6 mm-40 . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.786 0.327 . . . . 0.0 111.038 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 169.01 62.67 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.552 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -82.94 53.68 4.49 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.744 2.296 . . . . 0.0 112.44 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -175.31 -46.04 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.515 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.441 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.1 p -57.45 -29.46 64.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.884 0.373 . . . . 0.0 110.945 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.489 ' HG ' HG21 ' A' ' 66' ' ' ILE . 30.0 mt -60.14 -32.86 71.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.86 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 40.4 t -59.83 -52.33 62.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.096 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -53.76 -46.41 70.92 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.009 0.433 . . . . 0.0 110.657 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.487 ' CG1' ' HE3' ' A' ' 63' ' ' MET . 10.7 t -59.45 -43.24 90.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.436 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.93 -36.26 91.84 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.604 -0.808 . . . . 0.0 111.763 179.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -49.06 76.98 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.98 0.419 . . . . 0.0 110.218 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.97 HD13 HD13 ' A' ' 83' ' ' LEU . 6.6 mt -62.16 -38.8 90.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.945 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.522 ' HG2' HG21 ' A' ' 59' ' ' ILE . 0.4 OUTLIER -53.68 -37.79 63.56 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.757 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.42 -40.53 81.17 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.793 178.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -62.54 -36.91 84.11 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.046 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.443 HD11 ' HB2' ' A' ' 55' ' ' LEU . 3.3 mm? -62.61 -48.42 79.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.256 179.418 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -59.99 -35.07 74.23 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.361 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -60.59 -46.08 91.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.341 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.825 ' O ' HG23 ' A' ' 38' ' ' VAL . 18.9 m-85 -62.59 -41.16 98.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.415 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -57.84 -38.22 75.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.885 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.11 -54.39 30.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.554 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 29.1 t -58.33 -38.24 68.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.779 179.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.825 HG23 ' O ' ' A' ' 34' ' ' PHE . 45.2 t -74.99 -35.83 36.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.882 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.1 m -59.91 -34.88 73.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.633 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.55 -16.44 60.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.301 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.809 HD21 ' HE2' ' A' ' 98' ' ' LYS . 82.6 mt -75.51 -45.97 35.07 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.127 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 1.4 mptt 68.31 8.43 6.6 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.53 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -127.38 150.15 49.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.716 0.293 . . . . 0.0 110.684 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.63 ' O ' HG12 ' A' ' 48' ' ' VAL . . . 57.16 34.03 65.98 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.267 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.513 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 3.8 mmtp -63.01 -44.3 84.49 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.423 0.154 . . . . 0.0 111.389 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.513 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 32.2 Cg_exo -58.78 -49.18 12.22 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.495 2.13 . . . . 0.0 112.864 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -64.59 -50.09 68.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.734 0.302 . . . . 0.0 111.704 -179.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.77 HG11 HG11 ' A' ' 38' ' ' VAL . 14.7 p -66.88 -46.75 84.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.186 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.482 ' N ' HG13 ' A' ' 48' ' ' VAL . 95.7 m-20 -60.24 -28.98 68.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.833 0.349 . . . . 0.0 110.759 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 20.9 ttt-85 -74.16 -47.11 38.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.42 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.402 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 14.4 pt20 -72.37 -46.15 56.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.607 0.717 . . . . 0.0 109.268 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.612 HG13 HG22 ' A' ' 48' ' ' VAL . 1.2 mt -57.48 -39.45 68.97 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-N 114.646 -1.161 . . . . 0.0 110.459 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.452 ' O ' HG12 ' A' ' 57' ' ' ILE . 1.2 tmtt? -64.34 -47.78 78.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.592 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.494 ' HA ' HG12 ' A' ' 57' ' ' ILE . 14.2 m-20 -51.5 -49.18 62.37 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.707 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.443 ' HB2' HD11 ' A' ' 31' ' ' LEU . 14.2 mt -58.98 -40.73 85.7 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.493 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -56.99 -29.68 63.48 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.164 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.494 HG12 ' HA ' ' A' ' 54' ' ' ASN . 5.3 mm -71.19 -43.52 74.81 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.236 178.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.861 ' O ' HD12 ' A' ' 62' ' ' LEU . 28.3 t -57.94 -52.98 63.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.666 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.522 HG21 ' HG2' ' A' ' 28' ' ' LYS . 3.4 mt -58.38 -52.79 54.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.943 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.53 -36.47 71.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.492 179.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.99 -49.31 76.15 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.37 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.861 HD12 ' O ' ' A' ' 58' ' ' SER . 1.7 mp -55.21 -52.51 63.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.537 179.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.487 ' HE3' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.03 -55.93 5.12 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.131 179.853 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.53 -24.28 66.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.65 179.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.3 mtpt -82.06 -29.06 32.06 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-O 121.135 0.493 . . . . 0.0 110.488 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.659 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.1 mm -71.64 -39.5 69.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.225 -179.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -93.11 -28.28 16.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.695 -179.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.773 ' O ' HG23 ' A' ' 69' ' ' THR . 0.3 OUTLIER -103.73 24.25 11.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.759 0.314 . . . . 0.0 111.753 -179.553 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.773 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 176.92 150.09 0.15 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.057 179.488 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 1.9 mpp? -76.01 69.69 2.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.991 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.57 125.65 27.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.774 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.65 142.89 33.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.794 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.66 -35.12 60.68 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.938 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -59.28 -47.3 85.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.682 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -59.92 -32.48 70.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.465 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.602 ' CD1' HD23 ' A' ' 62' ' ' LEU . 26.9 mm -72.0 -34.27 50.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.702 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.22 -46.04 85.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.684 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -49.24 66.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.549 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.539 ' O ' HD12 ' A' ' 83' ' ' LEU . 2.4 mt-10 -56.5 -34.35 66.89 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.899 ' O ' HG23 ' A' ' 84' ' ' VAL . 16.9 t80 -64.73 -35.34 80.73 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 177.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -69.26 -37.52 77.98 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.954 178.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.19 -36.9 78.66 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 178.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.97 HD13 HD13 ' A' ' 27' ' ' LEU . 1.2 mt -75.48 -30.48 59.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.948 178.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.899 HG23 ' O ' ' A' ' 80' ' ' TYR . 93.2 t -67.88 -35.0 70.65 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.288 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.02 -49.38 37.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.206 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.9 -34.7 79.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.129 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.414 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 3.2 m -65.25 -46.35 80.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.286 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -56.36 -44.93 80.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.593 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -65.56 -30.68 71.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.689 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.569 HD23 ' C ' ' A' ' 90' ' ' LEU . 6.3 tt -64.26 -49.2 72.8 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.875 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.446 HD23 ' CD2' ' A' ' 90' ' ' LEU . 5.7 mt -60.67 -44.27 96.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.206 0.527 . . . . 0.0 110.018 179.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.52 -40.22 71.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.95 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.22 -53.7 34.01 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.083 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.418 HD13 HG22 ' A' ' 38' ' ' VAL . 67.2 mt -60.07 -38.17 82.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.736 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -54.2 48.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.909 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -56.42 -38.89 72.19 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.029 0.442 . . . . 0.0 110.314 179.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -51.78 62.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.886 179.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.809 ' HE2' HD21 ' A' ' 41' ' ' LEU . 3.2 mttm -60.69 -53.52 56.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.783 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -58.34 -25.36 61.86 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.682 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -69.1 -53.21 21.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.853 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 53.58 -176.38 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.078 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.86 -45.91 0.87 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.757 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.824 179.795 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.829 0.347 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 146.7 168.33 13.57 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.521 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.43 -176.1 1.55 Allowed 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.627 2.218 . . . . 0.0 112.361 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 164.48 -71.15 0.19 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.512 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.675 ' HB3' HG21 ' A' ' 76' ' ' ILE . 0.5 OUTLIER -94.58 -20.02 19.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.67 0.271 . . . . 0.0 111.098 179.985 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.7 mt -54.05 -32.83 55.74 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.098 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.524 HG13 ' N ' ' A' ' 23' ' ' LYS . 9.1 p -65.79 -47.84 84.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.251 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.524 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -59.42 -53.35 59.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.167 0.508 . . . . 0.0 110.519 179.726 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 1.052 HG12 HG23 ' A' ' 59' ' ' ILE . 3.8 t -56.79 -39.04 61.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.058 179.132 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -63.75 -37.29 94.47 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.596 -0.811 . . . . 0.0 111.158 178.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.5 m -57.09 -44.85 83.57 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 178.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.647 HD13 HD13 ' A' ' 83' ' ' LEU . 0.5 OUTLIER -61.75 -37.75 85.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.701 178.762 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.74 -40.33 69.2 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.82 -37.84 88.96 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.25 178.428 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.58 -34.31 77.54 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.861 179.066 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.818 HD22 HG23 ' A' ' 52' ' ' ILE . 9.4 mt -62.59 -50.26 71.98 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.958 179.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -57.81 -38.24 75.2 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.218 179.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.4 tptt -57.68 -44.56 85.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.295 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.818 ' O ' HG23 ' A' ' 38' ' ' VAL . 4.7 m-85 -61.22 -39.86 91.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.083 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -56.36 -43.72 79.42 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.355 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -59.9 -54.47 45.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.505 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 35.8 t -56.42 -37.88 53.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.687 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.974 HG21 HG11 ' A' ' 48' ' ' VAL . 60.5 t -71.79 -37.68 63.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.816 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 t -58.01 -37.25 73.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.36 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.47 -20.45 60.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.035 179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.513 HD11 ' HB3' ' A' ' 94' ' ' LEU . 43.2 mt -81.73 -28.42 33.38 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.953 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.5 -75.18 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.999 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -57.82 157.04 7.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.998 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.436 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 58.57 54.78 34.96 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.512 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.44 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -87.19 -49.68 0.46 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.578 0.228 . . . . 0.0 111.324 -179.737 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 52.5 Cg_exo -53.38 -41.88 69.64 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.556 2.17 . . . . 0.0 112.647 -179.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -56.62 -50.36 72.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.967 0.413 . . . . 0.0 110.888 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.974 HG11 HG21 ' A' ' 38' ' ' VAL . 2.1 t -64.34 -56.13 17.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.613 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 49.0 m-80 -54.82 -25.44 28.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.07 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.16 -48.65 41.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.851 0.357 . . . . 0.0 111.5 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -77.19 -45.3 27.11 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-O 121.409 0.623 . . . . 0.0 109.815 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.826 ' CD1' HG12 ' A' ' 48' ' ' VAL . 4.0 mt -57.77 -35.73 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.592 179.039 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.487 ' O ' HG12 ' A' ' 57' ' ' ILE . 2.9 tmtm? -69.88 -54.25 14.32 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.329 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.526 ' HA ' HG12 ' A' ' 57' ' ' ILE . 27.2 p30 -60.74 -30.77 70.2 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.524 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.602 HD22 HD23 ' A' ' 83' ' ' LEU . 75.2 mt -72.02 -38.94 69.49 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.23 -31.13 68.77 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.526 HG12 ' HA ' ' A' ' 54' ' ' ASN . 4.8 mm -68.09 -43.64 85.1 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.294 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.691 178.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.767 ' O ' HD12 ' A' ' 62' ' ' LEU . 5.1 t -58.56 -51.34 70.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.341 179.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 1.052 HG23 HG12 ' A' ' 24' ' ' VAL . 57.3 mt -61.69 -53.4 48.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.658 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.435 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 0.4 OUTLIER -55.17 -32.7 62.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.293 179.434 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.14 -49.23 75.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.761 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.767 HD12 ' O ' ' A' ' 58' ' ' SER . 0.9 OUTLIER -56.4 -57.3 12.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.069 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.53 ' SD ' HG22 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -46.0 -53.38 10.17 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.241 0.338 . . . . 0.0 110.967 -179.882 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.92 -24.48 66.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.923 0.392 . . . . 0.0 110.863 179.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.0 mtpt -82.61 -29.21 30.3 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.196 0.522 . . . . 0.0 110.652 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.643 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.6 mm -73.02 -35.59 48.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.132 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.62 -26.34 15.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.578 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.805 ' O ' HG23 ' A' ' 69' ' ' THR . 1.1 m -106.44 22.11 16.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.703 0.287 . . . . 0.0 111.705 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.805 HG23 ' O ' ' A' ' 68' ' ' SER . 0.6 OUTLIER 177.74 155.86 0.35 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.836 179.568 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 9.2 mtp -82.59 72.48 9.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.818 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.4 mmm -68.71 134.13 49.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.96 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.59 138.84 33.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.731 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.18 -31.57 53.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.911 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.82 -43.34 98.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.641 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -68.08 -31.5 71.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.685 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.675 HG21 ' HB3' ' A' ' 20' ' ' SER . 29.7 mm -71.82 -38.08 64.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.869 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -52.07 56.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.899 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.74 -48.85 79.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.721 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -56.35 -32.6 64.86 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 178.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.908 ' O ' HG23 ' A' ' 84' ' ' VAL . 1.9 t80 -64.65 -35.9 82.53 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 177.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -69.57 -37.66 77.06 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.057 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.05 -36.08 76.52 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 121.186 0.517 . . . . 0.0 109.678 178.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.647 HD13 HD13 ' A' ' 27' ' ' LEU . 3.0 mt -76.2 -30.54 58.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.004 178.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.908 HG23 ' O ' ' A' ' 80' ' ' TYR . 60.9 t -68.97 -35.84 71.09 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.457 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.01 -49.24 38.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.086 0.469 . . . . 0.0 110.322 179.52 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.1 p -65.01 -41.6 95.19 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.212 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.5 m -64.54 -50.17 68.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.587 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -51.97 -41.99 62.56 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.676 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.96 -30.64 68.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.723 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.0 tt -64.91 -48.98 72.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.431 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.9 mt -62.06 -49.57 75.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.068 0.461 . . . . 0.0 109.977 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.4 m -56.49 -30.7 63.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.72 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.49 ' HA ' ' HG2' ' A' ' 96' ' ' LYS . . . -69.88 -53.28 18.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.159 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.513 ' HB3' HD11 ' A' ' 41' ' ' LEU . 2.8 mt -61.87 -45.61 93.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.044 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.404 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 72.3 mt-30 -62.11 -44.93 95.58 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.207 -179.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.49 ' HG2' ' HA ' ' A' ' 93' ' ' ALA . 1.3 pttm -61.68 -29.49 70.12 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.936 0.398 . . . . 0.0 110.184 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.9 mtmm -69.1 -58.19 4.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.109 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.434 ' HD2' HD21 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -59.32 -50.94 72.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.534 -179.401 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -57.16 -39.96 76.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.158 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -59.76 -44.83 93.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.814 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 58.1 -177.45 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.925 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -132.17 7.77 4.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.503 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 C--N 1.331 -0.218 0 CA-C-O 120.711 0.291 . . . . 0.0 110.817 -179.977 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.834 0.349 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 147.3 -133.92 4.96 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.491 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -66.24 66.19 0.47 Allowed 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.695 2.263 . . . . 0.0 112.282 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.16 -45.02 0.89 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.377 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.11 -27.85 14.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.744 0.307 . . . . 0.0 110.78 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.562 ' HG ' HG21 ' A' ' 66' ' ' ILE . 10.4 mt -55.88 -32.94 64.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.046 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.495 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.6 p -63.84 -45.75 96.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.013 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.495 ' N ' HG13 ' A' ' 22' ' ' VAL . 21.1 mttt -60.3 -49.27 78.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.094 0.473 . . . . 0.0 110.48 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.458 ' CG1' HG23 ' A' ' 59' ' ' ILE . 21.6 t -56.96 -43.48 80.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.403 179.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.02 -38.05 95.44 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.645 -0.788 . . . . 0.0 111.452 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.2 m -56.76 -45.63 81.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.084 0.468 . . . . 0.0 109.938 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.85 ' CD2' HD13 ' A' ' 83' ' ' LEU . 8.6 tp -61.91 -38.37 88.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.895 179.119 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -41.22 67.94 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 178.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -65.06 -37.93 89.18 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.471 178.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.02 -33.39 75.94 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.929 178.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.782 HD12 HD12 ' A' ' 59' ' ' ILE . 5.1 mt -62.17 -51.91 65.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.166 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -57.91 -36.78 72.93 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.211 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.456 ' O ' HG23 ' A' ' 37' ' ' VAL . 22.1 tptt -58.61 -43.97 89.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.469 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.826 ' O ' HG23 ' A' ' 38' ' ' VAL . 16.2 m-85 -62.72 -42.56 99.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.424 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -54.13 -45.64 71.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.838 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -55.27 32.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.895 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 33' ' ' LYS . 31.5 t -55.94 -38.69 53.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.914 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.858 HG11 HG11 ' A' ' 48' ' ' VAL . 46.6 t -75.19 -33.81 29.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.75 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.0 t -61.2 -33.29 73.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.512 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.2 -29.95 67.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.779 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.722 HD22 ' HE2' ' A' ' 98' ' ' LYS . 0.9 OUTLIER -116.55 79.92 1.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.797 179.842 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.45 -27.9 2.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.396 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -56.38 107.39 0.37 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.967 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.586 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 80.89 54.59 3.58 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.321 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.491 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -82.61 -45.97 0.92 Allowed Pre-proline 0 C--N 1.329 -0.301 0 N-CA-C 111.44 0.163 . . . . 0.0 111.44 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.491 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 52.7 Cg_exo -53.19 -43.75 54.61 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.296 1.998 . . . . 0.0 112.424 -179.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -58.37 -49.53 76.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.941 0.401 . . . . 0.0 110.622 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.858 HG11 HG11 ' A' ' 38' ' ' VAL . 4.9 t -60.86 -54.93 28.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.74 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.429 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 21.2 m-80 -54.02 -25.73 22.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.032 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.83 -51.74 20.96 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.955 0.407 . . . . 0.0 111.52 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -73.26 -45.41 55.95 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.469 0.652 . . . . 0.0 109.276 179.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.652 HG13 HG12 ' A' ' 48' ' ' VAL . 1.4 mt -57.51 -31.95 40.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.312 178.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 25.6 tttt -69.32 -52.41 27.59 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.475 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.914 ' HA ' HD12 ' A' ' 57' ' ' ILE . 17.9 m-20 -51.14 -41.68 60.25 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.834 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.8 mp -68.86 -42.98 76.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.256 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.402 ' HA ' ' CD1' ' A' ' 31' ' ' LEU . 0.5 OUTLIER -56.75 -36.6 69.95 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 178.579 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.914 HD12 ' HA ' ' A' ' 54' ' ' ASN . 11.8 mt -71.31 -42.43 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.329 178.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.855 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.1 m -59.73 -54.97 40.12 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.722 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.782 HD12 HD12 ' A' ' 31' ' ' LEU . 45.6 mt -58.5 -53.94 39.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.879 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.9 -34.39 67.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.578 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.58 -49.62 76.8 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.244 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.855 HD12 ' O ' ' A' ' 58' ' ' SER . 2.1 mp -55.53 -54.73 40.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.463 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.45 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -44.86 -57.0 4.04 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.19 -179.839 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.06 -24.8 64.85 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.832 0.348 . . . . 0.0 110.599 179.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.488 ' HA ' HG23 ' A' ' 69' ' ' THR . 15.7 mtpt -81.96 -29.76 32.02 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.624 179.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -71.88 -33.76 49.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.076 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 21.2 mmmt -93.82 -2.51 53.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.273 -179.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.515 ' O ' HG22 ' A' ' 69' ' ' THR . 13.0 m -140.17 19.87 2.43 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.515 HG22 ' O ' ' A' ' 68' ' ' SER . 0.4 OUTLIER -161.64 161.72 29.68 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.495 179.281 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -95.23 45.65 1.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.028 0.442 . . . . 0.0 110.58 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.84 130.43 29.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.215 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.6 m -80.08 142.38 34.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.747 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -30.52 59.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.74 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -47.25 86.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.434 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -64.31 -32.82 74.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.434 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.653 ' CD1' HD23 ' A' ' 62' ' ' LEU . 25.4 mm -70.59 -36.81 67.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.742 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 11.8 tp-100 -63.32 -52.21 62.81 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.77 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.8 tptt -62.18 -46.62 88.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.561 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -56.45 -33.31 65.77 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.902 ' O ' HG23 ' A' ' 84' ' ' VAL . 2.1 t80 -64.35 -37.5 87.74 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 177.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.86 -36.54 75.6 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.977 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.45 -36.07 75.24 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.247 0.546 . . . . 0.0 109.794 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.85 HD13 ' CD2' ' A' ' 27' ' ' LEU . 2.7 mt -76.74 -31.18 56.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.032 179.019 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.902 HG23 ' O ' ' A' ' 80' ' ' TYR . 47.7 t -69.83 -35.14 63.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.617 179.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -72.21 -49.46 35.22 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.447 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.4 m -66.03 -40.33 90.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.435 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.417 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 28.4 t -64.89 -50.06 68.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.607 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -52.84 -44.43 66.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.842 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -69.41 -27.68 65.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.82 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.594 HD11 HG12 ' A' ' 52' ' ' ILE . 7.3 tt -67.73 -49.22 63.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.067 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 87' ' ' SER . 6.9 mt -62.3 -49.11 76.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.175 0.512 . . . . 0.0 109.863 179.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.3 m -55.42 -37.65 67.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.46 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.4 -40.28 74.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.827 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.575 ' CD2' HG22 ' A' ' 38' ' ' VAL . 10.6 tp -62.64 -51.8 65.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -55.91 -50.53 70.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.618 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -58.81 -28.98 66.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.128 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.8 tttm -62.77 -52.17 64.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.611 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.722 ' HE2' HD22 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -60.19 -53.37 58.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.774 -179.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -25.53 63.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.705 179.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -70.16 -49.09 54.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.814 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 55.9 -179.39 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.904 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -60.48 -72.87 0.1 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.827 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.827 -179.992 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.892 0.377 . . . . 0.0 110.999 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 135.92 69.18 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.583 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -74.79 -32.07 6.04 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.56 2.173 . . . . 0.0 112.273 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.54 71.2 0.36 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.54 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.669 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.9 p -178.1 -40.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.795 0.331 . . . . 0.0 110.838 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.517 ' HG ' HG21 ' A' ' 66' ' ' ILE . 3.4 mp -64.38 -32.64 74.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.029 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 32.4 t -62.5 -52.78 55.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.291 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.2 tptt -54.17 -45.22 72.04 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.919 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.779 HG12 HG23 ' A' ' 59' ' ' ILE . 11.5 t -56.73 -49.15 79.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.296 179.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.9 -40.07 98.37 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.554 -0.831 . . . . 0.0 111.559 178.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.808 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.1 OUTLIER -56.71 -42.32 78.97 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.253 0.549 . . . . 0.0 109.716 179.269 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.65 HD13 HD13 ' A' ' 83' ' ' LEU . 0.8 OUTLIER -59.91 -39.63 86.09 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.181 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -53.88 -35.02 61.14 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.808 ' HG3' ' HA ' ' A' ' 26' ' ' THR . 2.6 mmtt -60.17 -48.26 82.48 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.366 -0.833 . . . . 0.0 109.14 177.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.94 -33.86 62.66 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.402 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.542 HD13 HD11 ' A' ' 59' ' ' ILE . 1.4 mp -63.47 -49.74 72.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.244 179.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.67 -32.91 70.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.324 179.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 tppt? -61.91 -45.93 91.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.284 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.792 ' O ' HG23 ' A' ' 38' ' ' VAL . 8.5 m-85 -60.09 -50.17 74.77 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.659 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -54.22 -38.6 65.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.918 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -51.71 68.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.014 0.435 . . . . 0.0 110.599 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.451 HG12 HD23 ' A' ' 41' ' ' LEU . 30.7 t -62.67 -37.85 80.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.736 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 1.034 HG22 HD21 ' A' ' 94' ' ' LEU . 59.9 t -63.07 -36.22 74.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.954 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.5 m -75.83 -29.22 58.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.926 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.22 -29.21 38.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.376 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.565 HD22 ' HE3' ' A' ' 98' ' ' LYS . 3.6 pp -93.4 -35.94 12.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.999 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.49 ' N ' HD12 ' A' ' 41' ' ' LEU . 1.3 mptt 58.41 102.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.97 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 174.9 122.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.729 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.633 ' O ' HG12 ' A' ' 48' ' ' VAL . . . 58.14 68.09 1.87 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.477 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.468 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -69.5 -47.59 25.87 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 111.553 0.205 . . . . 0.0 111.553 -179.705 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.468 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 35.8 Cg_exo -60.52 -49.38 9.04 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.504 2.136 . . . . 0.0 113.07 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 2.0 pm0 -58.21 -50.03 74.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.845 0.355 . . . . 0.0 111.649 -179.135 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.755 HG11 HG11 ' A' ' 38' ' ' VAL . 14.6 p -72.66 -46.55 53.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.343 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.483 ' N ' HG13 ' A' ' 48' ' ' VAL . 98.9 m-20 -59.43 -39.0 82.14 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.992 -0.283 . . . . 0.0 111.528 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.423 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 27.8 ptt180 -71.48 -41.85 68.83 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -179.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.404 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 28.9 mt-30 -71.78 -46.87 56.94 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 179.187 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.641 HG13 ' O ' ' A' ' 48' ' ' VAL . 1.1 mt -57.33 -30.0 34.43 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 CA-C-N 114.65 -1.159 . . . . 0.0 110.059 178.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.499 ' HD3' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -69.07 -51.15 41.72 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.342 179.035 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.911 ' HA ' HD12 ' A' ' 57' ' ' ILE . 16.2 m-20 -51.5 -41.44 60.99 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.601 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 26.3 mt -67.41 -43.83 80.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.219 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.486 ' N ' HD21 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -56.74 -37.56 71.17 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.515 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.911 HD12 ' HA ' ' A' ' 54' ' ' ASN . 9.7 mt -71.26 -40.76 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.134 178.557 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.841 ' O ' HD12 ' A' ' 62' ' ' LEU . 39.9 t -57.83 -53.01 63.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.477 179.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.779 HG23 HG12 ' A' ' 24' ' ' VAL . 4.4 mt -60.39 -52.98 55.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.568 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.77 -33.67 68.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.465 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.84 -49.36 78.01 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.271 179.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.841 HD12 ' O ' ' A' ' 58' ' ' SER . 1.2 mp -55.42 -55.1 35.6 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.703 179.448 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.426 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -44.93 -58.54 3.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.164 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.49 -23.8 63.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.683 179.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.512 ' HA ' HG23 ' A' ' 69' ' ' THR . 1.0 OUTLIER -82.48 -29.79 30.34 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.545 179.511 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.662 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.9 mm -71.63 -35.78 57.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.236 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.7 mmmt -96.07 1.41 52.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.347 -179.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.488 ' O ' HG22 ' A' ' 69' ' ' THR . 19.5 m -141.93 23.33 2.07 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.512 HG23 ' HA ' ' A' ' 65' ' ' LYS . 0.7 OUTLIER -160.39 174.03 14.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.924 0.392 . . . . 0.0 110.756 179.239 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.17 38.2 2.27 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.643 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 11.0 mmm -55.52 141.3 37.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.059 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 2.3 m -84.9 145.25 27.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.754 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.4 -31.46 61.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.755 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.11 -37.9 84.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.394 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -68.59 -32.57 72.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.515 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.6 ' CD1' HD23 ' A' ' 62' ' ' LEU . 25.6 mm -72.51 -34.48 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.717 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.02 -50.72 61.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.66 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.9 -46.3 88.47 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.5 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -56.45 -34.22 66.64 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.913 ' O ' HG23 ' A' ' 84' ' ' VAL . 3.3 t80 -64.15 -37.06 86.11 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 177.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.43 -36.89 77.1 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.938 178.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.59 -36.33 76.06 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.126 0.488 . . . . 0.0 109.687 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.65 HD13 HD13 ' A' ' 27' ' ' LEU . 4.7 mt -76.43 -32.42 58.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.917 178.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.913 HG23 ' O ' ' A' ' 80' ' ' TYR . 58.9 t -67.95 -34.3 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.428 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -48.81 39.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.357 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.14 -38.51 91.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.574 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.444 ' HB2' ' CZ ' ' A' ' 34' ' ' PHE . 25.6 p -66.13 -46.49 77.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.596 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.81 -44.21 73.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.972 0.415 . . . . 0.0 110.559 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -67.93 -30.57 69.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.681 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.598 HD11 HD11 ' A' ' 52' ' ' ILE . 7.6 tt -62.77 -47.75 82.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.739 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.666 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.8 mt -62.41 -49.19 76.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.124 0.488 . . . . 0.0 109.708 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 24.1 m -57.1 -40.34 76.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.473 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.73 -51.71 46.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.712 179.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 1.034 HD21 HG22 ' A' ' 38' ' ' VAL . 1.2 mp -53.48 -51.6 62.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.794 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -55.67 -40.27 72.06 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.089 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.05 -53.28 60.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.61 179.351 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.4 mttt -54.67 -36.54 64.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.196 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.565 ' HE3' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -63.98 -53.93 42.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.987 0.422 . . . . 0.0 110.656 179.925 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -62.71 -25.3 68.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.572 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -77.38 -52.84 8.48 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.134 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -127.62 150.91 49.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.007 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -97.38 -38.5 9.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.923 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.035 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.88 0.371 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -159.81 -95.43 0.11 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.479 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.546 ' HA ' HD12 ' A' ' 21' ' ' LEU . 52.1 Cg_exo -52.88 158.48 6.35 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.548 2.165 . . . . 0.0 112.321 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.95 -41.64 2.13 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.502 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.694 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.4 m -100.53 -30.51 11.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.857 0.361 . . . . 0.0 110.911 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.546 HD12 ' HA ' ' A' ' 18' ' ' PRO . 1.1 mt -66.13 -32.89 74.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.014 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.529 HG13 ' N ' ' A' ' 23' ' ' LYS . 9.1 p -60.63 -49.42 84.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.358 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.529 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -64.32 -46.4 83.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.852 0.358 . . . . 0.0 110.648 179.8 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.694 HG23 ' O ' ' A' ' 20' ' ' SER . 44.4 t -56.84 -40.68 72.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.203 179.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -65.14 -41.98 96.72 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.646 -0.787 . . . . 0.0 111.424 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.606 ' HA ' ' HG3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -57.97 -33.26 68.68 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.133 0.492 . . . . 0.0 109.998 179.2 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.887 ' CD2' HD13 ' A' ' 83' ' ' LEU . 13.6 tp -67.98 -45.49 73.98 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.0 mttm -52.8 -33.67 50.04 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.606 ' HG3' ' HA ' ' A' ' 26' ' ' THR . 15.7 mttt -63.52 -47.27 82.35 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.831 178.321 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.453 ' HG2' ' CZ ' ' A' ' 34' ' ' PHE . 63.1 ttt180 -61.34 -32.28 72.16 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.409 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.446 HD23 ' HG2' ' A' ' 56' ' ' GLU . 4.2 mp -62.47 -50.6 70.81 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.268 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -58.03 -37.64 74.74 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.12 0.486 . . . . 0.0 109.915 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.423 ' O ' HG23 ' A' ' 37' ' ' VAL . 24.7 tptt -57.75 -42.83 84.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.061 179.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.854 ' O ' HG23 ' A' ' 38' ' ' VAL . 18.9 m-30 -62.5 -42.46 99.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.254 179.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -53.19 -46.14 68.88 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.649 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -59.98 -54.32 47.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.505 179.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 33' ' ' LYS . 35.8 t -56.05 -37.86 50.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.559 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.939 HG11 HG11 ' A' ' 48' ' ' VAL . 44.5 t -74.09 -33.53 35.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.583 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.3 t -61.76 -32.93 73.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.313 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.28 -27.44 56.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.212 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.789 HD21 ' HD2' ' A' ' 98' ' ' LYS . 18.7 mt -59.78 -45.76 91.29 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.929 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 63.61 14.7 8.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.487 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -133.55 134.14 42.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.849 0.357 . . . . 0.0 110.9 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.551 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 59.0 69.81 1.17 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.487 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.528 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 2.0 mmpm? -82.93 -42.99 0.88 Allowed Pre-proline 0 C--N 1.329 -0.322 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.1 Cg_exo -53.6 -49.0 18.85 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.301 2.0 . . . . 0.0 112.374 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.436 ' HA ' ' HG2' ' A' ' 50' ' ' ARG . 0.9 OUTLIER -55.6 -46.93 77.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.011 0.434 . . . . 0.0 111.076 179.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.939 HG11 HG11 ' A' ' 38' ' ' VAL . 11.8 t -65.83 -55.69 18.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.136 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -53.43 -34.9 59.59 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -179.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.448 ' HG3' ' N ' ' A' ' 51' ' ' GLN . 5.3 ptp85 -74.37 -35.23 63.53 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -179.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.448 ' N ' ' HG3' ' A' ' 50' ' ' ARG . 26.2 mt-30 -80.71 -47.56 13.81 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.554 0.692 . . . . 0.0 109.531 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.624 HG13 ' O ' ' A' ' 48' ' ' VAL . 2.6 mt -60.23 -33.67 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.101 178.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.03 -54.13 14.53 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.265 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.96 ' HA ' HD12 ' A' ' 57' ' ' ILE . 26.8 p30 -59.01 -25.48 63.69 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.738 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.547 HD22 HD23 ' A' ' 83' ' ' LEU . 84.6 mt -79.27 -44.44 21.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.356 . . . . 0.0 110.102 178.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.446 ' HG2' HD23 ' A' ' 31' ' ' LEU . 1.8 tm-20 -56.71 -35.67 68.8 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.96 HD12 ' HA ' ' A' ' 54' ' ' ASN . 12.0 mt -70.54 -41.88 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.127 178.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.69 ' O ' HD12 ' A' ' 62' ' ' LEU . 24.2 m -58.69 -55.14 38.91 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.472 179.569 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.562 HG12 HD23 ' A' ' 27' ' ' LEU . 4.0 mt -60.61 -52.51 60.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.63 179.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -58.48 -34.1 70.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.505 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.33 -49.63 76.51 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.024 0.44 . . . . 0.0 110.023 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.69 HD12 ' O ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -55.61 -52.81 62.52 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.277 178.967 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.497 ' HE2' HG11 ' A' ' 24' ' ' VAL . 17.7 tpp -45.02 -57.92 3.52 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.211 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.9 -24.2 64.1 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.619 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.469 ' HA ' HG23 ' A' ' 69' ' ' THR . 2.8 mtmp? -81.97 -29.78 31.98 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.539 179.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.655 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.8 mm -71.63 -36.38 59.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.095 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt -96.18 1.23 52.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.945 -0.571 . . . . 0.0 112.265 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.49 ' O ' HG22 ' A' ' 69' ' ' THR . 3.0 t -138.46 20.49 2.74 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.49 HG22 ' O ' ' A' ' 68' ' ' SER . 0.7 OUTLIER -160.84 177.08 10.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.888 0.375 . . . . 0.0 110.649 179.405 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.3 ttt -109.21 41.39 1.64 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.536 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 15.3 mmm -55.49 145.02 23.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.138 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.48 146.65 23.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.797 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 86.4 mtm-85 -54.75 -31.37 58.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.797 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.8 -39.0 87.26 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.414 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -67.47 -34.3 76.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.433 179.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.571 HD13 HD23 ' A' ' 62' ' ' LEU . 26.1 mm -72.09 -34.0 48.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.721 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -66.68 -46.34 75.95 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.801 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 4.8 mmmt -66.54 -47.54 72.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.694 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -56.66 -34.18 67.09 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.809 ' O ' HG23 ' A' ' 84' ' ' VAL . 88.3 t80 -64.96 -36.67 85.13 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.77 -37.79 76.52 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.936 178.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.98 -32.26 71.82 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 121.111 0.481 . . . . 0.0 109.758 178.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.887 HD13 ' CD2' ' A' ' 27' ' ' LEU . 5.0 mt -78.31 -30.62 48.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.021 178.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.809 HG23 ' O ' ' A' ' 80' ' ' TYR . 60.2 t -68.97 -37.05 76.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.368 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -49.15 35.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.452 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.7 p -64.47 -45.28 88.05 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.727 179.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 89.4 p -60.21 -49.28 78.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.56 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -54.5 -39.52 67.64 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.764 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -68.12 -31.63 71.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.753 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.447 HD23 HD23 ' A' ' 91' ' ' LEU . 6.8 tt -66.05 -46.46 77.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.997 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.447 HD23 HD23 ' A' ' 90' ' ' LEU . 6.5 mt -65.14 -48.52 73.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.169 0.509 . . . . 0.0 109.809 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.3 m -57.07 -32.68 66.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.539 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.416 ' O ' ' CG ' ' A' ' 96' ' ' LYS . . . -70.07 -53.11 18.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.777 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.657 ' HB3' HD11 ' A' ' 41' ' ' LEU . 14.4 mt -58.87 -42.2 88.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.672 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.97 -49.71 75.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.036 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.425 ' HA ' ' HG2' ' A' ' 99' ' ' GLN . 27.3 pttt -61.61 -28.65 69.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.939 0.399 . . . . 0.0 110.46 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mttm -70.8 -50.47 35.26 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.692 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.789 ' HD2' HD21 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -70.75 -45.8 64.13 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 121.102 -0.239 . . . . 0.0 111.503 -179.203 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . 0.425 ' HG2' ' HA ' ' A' ' 96' ' ' LYS . 19.9 pt20 -59.63 -46.66 88.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.696 0.284 . . . . 0.0 111.263 -179.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -64.22 -39.83 94.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.828 0.347 . . . . 0.0 110.88 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.28 -30.08 70.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.805 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -86.31 -78.12 0.29 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.865 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.833 -179.918 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.724 0.297 . . . . 0.0 110.797 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -113.17 92.39 0.62 Allowed Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.573 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -54.88 90.3 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.54 2.16 . . . . 0.0 112.274 179.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -134.85 41.91 1.4 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.525 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.885 ' O ' HG23 ' A' ' 24' ' ' VAL . 1.5 m -164.32 -43.76 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.766 0.317 . . . . 0.0 110.83 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.703 ' HG ' HG21 ' A' ' 66' ' ' ILE . 2.6 mt -57.06 -35.97 69.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.072 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.503 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.8 p -69.34 -46.69 76.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.191 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.503 ' N ' HG13 ' A' ' 22' ' ' VAL . 25.2 mttt -60.15 -46.52 89.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.168 0.509 . . . . 0.0 110.506 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.885 HG23 ' O ' ' A' ' 20' ' ' SER . 14.4 t -56.83 -45.97 83.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.632 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.76 -38.77 95.75 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.55 -0.833 . . . . 0.0 111.704 179.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -56.89 -43.85 81.74 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.057 0.456 . . . . 0.0 110.153 179.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.464 HD13 HD13 ' A' ' 83' ' ' LEU . 0.7 OUTLIER -61.63 -42.02 98.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.054 179.254 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.427 ' HA ' HD13 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -52.88 -40.07 63.19 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 178.786 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.53 -38.64 91.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.63 178.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.431 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -63.48 -36.56 84.16 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.922 179.12 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.732 HD22 HD12 ' A' ' 59' ' ' ILE . 5.9 mp -62.03 -43.52 98.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.254 179.334 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.28 -47.42 85.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.843 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.454 ' O ' HG23 ' A' ' 37' ' ' VAL . 0.0 OUTLIER -60.06 -33.64 72.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.006 -179.991 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.848 ' O ' HG23 ' A' ' 38' ' ' VAL . 10.8 m-85 -65.59 -43.91 88.25 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.512 179.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -60.77 -39.3 88.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.476 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -59.15 -54.69 44.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.478 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 33' ' ' LYS . 24.0 t -58.8 -37.9 69.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.781 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.901 HG11 HG11 ' A' ' 48' ' ' VAL . 55.0 t -70.74 -31.45 45.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.061 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.3 m -73.82 -27.1 60.94 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.98 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.45 -34.86 65.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.413 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.79 HD12 ' O ' ' A' ' 42' ' ' LYS . 4.1 pp -87.79 -25.98 23.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.284 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.79 ' O ' HD12 ' A' ' 41' ' ' LEU . 4.7 mptt 58.55 179.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.974 0.416 . . . . 0.0 111.114 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.5 t70 70.13 149.12 0.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.749 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.595 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 62.47 24.76 66.2 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.375 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.454 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 0.0 OUTLIER -54.3 -48.93 93.12 Favored Pre-proline 0 C--N 1.331 -0.204 0 N-CA-C 111.516 0.191 . . . . 0.0 111.516 -179.836 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 50.5 Cg_exo -53.79 -46.84 30.73 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.292 1.995 . . . . 0.0 112.581 -179.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -63.12 -50.44 70.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.412 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.901 HG11 HG11 ' A' ' 38' ' ' VAL . 11.9 t -65.11 -55.78 18.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.148 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.629 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 73.6 m-20 -54.07 -28.42 38.82 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.224 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.4 -49.54 33.07 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.416 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 28.4 mt-30 -74.15 -43.5 57.2 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.532 0.682 . . . . 0.0 109.588 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.605 HG13 HG12 ' A' ' 48' ' ' VAL . 1.2 mt -57.15 -36.2 50.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.376 179.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.933 ' HD2' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -69.08 -46.02 68.84 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.187 178.835 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.912 ' HA ' HD12 ' A' ' 57' ' ' ILE . 27.7 m-20 -51.19 -41.34 60.15 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.732 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.592 ' HB2' HD21 ' A' ' 31' ' ' LEU . 5.3 mt -69.25 -43.3 74.25 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 120.722 0.296 . . . . 0.0 110.351 179.33 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.443 ' N ' HD21 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -56.56 -36.43 69.31 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.606 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.933 HD11 ' HD2' ' A' ' 53' ' ' LYS . 10.9 mt -70.96 -42.25 77.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 115.096 -0.957 . . . . 0.0 110.171 178.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.904 ' O ' HD12 ' A' ' 62' ' ' LEU . 10.5 m -59.49 -46.12 89.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.419 179.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.779 HG23 HG12 ' A' ' 24' ' ' VAL . 46.3 mt -63.97 -53.49 43.37 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.527 179.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.435 ' HA ' ' CG ' ' A' ' 63' ' ' MET . 96.0 m-20 -57.26 -34.19 68.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.301 179.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.88 -49.1 78.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.783 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.904 HD12 ' O ' ' A' ' 58' ' ' SER . 0.8 OUTLIER -55.78 -56.49 19.93 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.998 179.929 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.439 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.6 -53.78 8.62 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 123.198 0.311 . . . . 0.0 110.792 -179.92 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.07 -25.19 66.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.927 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.447 ' O ' HG23 ' A' ' 69' ' ' THR . 2.3 mtmp? -82.35 -30.42 30.38 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.137 0.494 . . . . 0.0 110.596 179.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.703 HG21 ' HG ' ' A' ' 21' ' ' LEU . 1.5 mm -71.22 -33.81 52.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.99 -179.495 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.81 0.95 57.51 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.214 -179.302 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.471 ' O ' HG22 ' A' ' 69' ' ' THR . 2.2 m -142.88 22.12 1.94 Allowed 'General case' 0 C--O 1.233 0.192 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.471 HG22 ' O ' ' A' ' 68' ' ' SER . 1.0 OUTLIER -160.34 157.4 27.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.605 179.206 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.63 36.49 1.77 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.49 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.7 138.71 55.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.071 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.43 HG22 ' H ' ' A' ' 74' ' ' GLU . 13.9 m -74.32 145.71 43.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.806 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.26 -30.61 62.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.668 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.43 ' H ' HG22 ' A' ' 72' ' ' THR . 1.4 tt0 -59.37 -45.1 92.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.427 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -60.24 -33.58 72.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.376 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.667 ' CD1' HD23 ' A' ' 62' ' ' LEU . 19.1 mm -70.88 -34.07 54.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.497 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -50.88 68.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.609 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.8 mmtm -61.14 -46.34 90.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.47 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -56.52 -33.47 66.08 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.925 ' O ' HG23 ' A' ' 84' ' ' VAL . 2.5 t80 -63.81 -38.08 89.78 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 177.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.6 -36.36 76.14 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.144 178.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.97 -37.36 76.6 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.253 0.549 . . . . 0.0 109.921 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.71 HD21 ' HB2' ' A' ' 58' ' ' SER . 24.8 mt -76.48 -30.08 57.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.112 178.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.925 HG23 ' O ' ' A' ' 80' ' ' TYR . 49.0 t -71.11 -34.66 55.74 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.543 179.426 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -72.02 -49.28 38.27 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.436 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.5 m -62.95 -40.81 98.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.28 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.404 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 3.0 m -62.93 -50.07 72.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.513 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -52.38 -41.75 63.39 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.021 0.439 . . . . 0.0 110.747 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -67.5 -32.74 73.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.688 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.515 HD23 HD12 ' A' ' 94' ' ' LEU . 5.1 tt -64.98 -47.08 78.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.964 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.75 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.7 mt -60.88 -48.79 80.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.238 0.542 . . . . 0.0 109.982 179.63 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.04 -42.69 72.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.334 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.91 -36.83 84.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.316 179.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.671 HD22 HD21 ' A' ' 41' ' ' LEU . 5.9 mt -66.91 -42.68 85.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.427 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.522 ' HA ' ' HD2' ' A' ' 98' ' ' LYS . 0.6 OUTLIER -55.95 -54.19 47.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.325 179.635 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.77 -28.74 69.66 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.261 179.187 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.3 tttm -66.63 -43.33 84.98 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.156 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.537 ' CE ' HD22 ' A' ' 41' ' ' LEU . 14.2 mttt -66.01 -53.66 35.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.223 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -25.53 67.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.719 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -72.01 -53.33 13.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.903 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -144.88 145.39 31.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.882 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.94 -45.06 0.52 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.152 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.943 -179.966 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 . . . . . 0 C--O 1.233 0.208 0 CA-C-O 120.779 0.323 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 112.3 -144.63 17.85 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.559 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.01 -170.75 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.57 2.18 . . . . 0.0 112.389 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 83.77 142.89 5.27 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.359 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.41 ' O ' HG23 ' A' ' 24' ' ' VAL . 2.4 m 75.15 -58.05 0.58 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.672 0.272 . . . . 0.0 111.034 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.614 HD21 ' HB ' ' A' ' 66' ' ' ILE . 0.5 OUTLIER -53.67 -32.76 52.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.085 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.515 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.0 p -57.74 -48.35 83.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.303 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.515 ' N ' HG13 ' A' ' 22' ' ' VAL . 22.0 mttt -64.48 -41.92 96.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.888 0.375 . . . . 0.0 110.421 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.584 HG12 HG23 ' A' ' 59' ' ' ILE . 25.5 t -57.48 -48.49 82.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.703 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -59.35 -41.22 96.83 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.624 -0.798 . . . . 0.0 111.801 179.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.69 -36.3 74.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.905 0.383 . . . . 0.0 110.263 179.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.521 HD13 HD13 ' A' ' 83' ' ' LEU . 0.4 OUTLIER -64.59 -47.01 80.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.752 179.336 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.53 ' HA ' HD13 ' A' ' 59' ' ' ILE . 5.4 tttm -53.18 -36.37 60.86 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -68.72 -35.11 76.72 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.451 178.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -34.48 77.86 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.893 178.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.568 HD21 ' HB2' ' A' ' 55' ' ' LEU . 6.2 mp -63.71 -50.36 69.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.128 179.251 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -58.02 -35.76 71.73 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.19 179.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.9 tptt -60.4 -46.13 91.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.348 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.842 ' O ' HG23 ' A' ' 38' ' ' VAL . 21.3 m-85 -59.59 -42.7 93.14 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.49 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -58.28 -40.77 82.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.474 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -59.47 -49.74 76.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.508 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.4 t -63.2 -37.9 80.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.505 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.842 HG23 ' O ' ' A' ' 34' ' ' PHE . 57.2 t -68.23 -38.26 79.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.787 179.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.3 m -67.58 -30.72 70.41 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.738 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.57 -29.74 69.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.276 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.573 HD12 ' O ' ' A' ' 42' ' ' LYS . 1.2 pp -100.99 -22.52 14.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.208 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.573 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.2 OUTLIER 63.08 -173.82 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.912 179.902 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 62.24 155.46 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.758 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.811 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 63.7 33.16 86.51 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.319 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.568 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 16.8 mmtp -62.97 -55.29 38.98 Favored Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.568 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 10.0 Cg_endo -53.55 -43.03 61.13 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.561 2.174 . . . . 0.0 112.856 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -66.5 -41.02 89.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.786 0.327 . . . . 0.0 111.185 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 44' ' ' GLY . 47.4 t -71.19 -56.24 11.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.45 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.466 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 21.1 p30 -59.26 -25.46 64.08 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.946 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 11.1 ttt-85 -72.92 -47.14 48.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.778 0.323 . . . . 0.0 111.386 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -76.64 -46.05 27.46 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.421 0.629 . . . . 0.0 109.598 179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.762 ' HA ' HD12 ' A' ' 55' ' ' LEU . 1.8 mt -57.39 -34.09 45.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.372 179.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.688 ' HG3' HD11 ' A' ' 57' ' ' ILE . 4.9 tptt -69.41 -52.36 27.69 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.534 179.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.927 ' HA ' HD12 ' A' ' 57' ' ' ILE . 15.2 m-20 -51.52 -34.16 34.94 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.539 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.762 HD12 ' HA ' ' A' ' 52' ' ' ILE . 2.9 mt -76.63 -43.26 39.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.392 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.567 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -56.71 -35.0 68.01 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.415 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.927 HD12 ' HA ' ' A' ' 54' ' ' ASN . 14.0 mt -70.49 -43.49 77.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.187 178.728 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.887 ' O ' HD12 ' A' ' 62' ' ' LEU . 6.7 t -57.91 -45.92 85.77 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.681 179.576 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.584 HG23 HG12 ' A' ' 24' ' ' VAL . 13.9 mt -59.94 -54.47 34.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.757 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -57.54 -33.52 68.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.622 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.81 -49.55 77.27 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.474 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.887 HD12 ' O ' ' A' ' 58' ' ' SER . 1.5 mp -55.73 -55.03 37.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.695 179.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.494 ' HE2' HG11 ' A' ' 24' ' ' VAL . 9.3 tpp -45.12 -55.57 5.56 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.267 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.89 -24.24 66.82 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.805 0.336 . . . . 0.0 110.546 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.6 mtmm -82.25 -28.91 31.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.473 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.653 HG12 ' O ' ' A' ' 62' ' ' LEU . 2.1 mm -71.88 -40.65 68.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.336 -179.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -92.56 -29.05 16.38 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.773 -179.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.762 ' O ' HG23 ' A' ' 69' ' ' THR . 1.2 t -103.14 24.41 10.89 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.714 0.264 . . . . 0.0 111.714 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.762 HG23 ' O ' ' A' ' 68' ' ' SER . 0.2 OUTLIER 177.53 150.14 0.18 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.156 179.623 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 11.0 ttp -75.17 64.37 1.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.872 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.515 ' CE ' HD13 ' A' ' 76' ' ' ILE . 0.5 OUTLIER -62.63 124.49 21.12 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.779 179.992 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.8 m -77.11 136.38 38.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.771 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.3 mtm180 -52.77 -35.29 56.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.911 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -59.94 -42.34 93.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.458 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -67.22 -32.59 73.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.515 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.564 HD13 HD23 ' A' ' 62' ' ' LEU . 27.1 mm -70.11 -37.13 71.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.828 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -65.1 -50.36 66.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.692 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -63.57 -46.9 83.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.675 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.427 ' O ' HD12 ' A' ' 83' ' ' LEU . 1.1 mt-10 -56.46 -34.0 66.45 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.933 ' O ' HG23 ' A' ' 84' ' ' VAL . 3.5 t80 -64.15 -37.36 87.16 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -69.72 -36.8 76.2 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.17 178.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.74 -39.89 78.41 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.249 0.547 . . . . 0.0 109.681 179.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.716 HD21 ' HB3' ' A' ' 58' ' ' SER . 1.4 mt -74.34 -30.19 61.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.062 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.933 HG23 ' O ' ' A' ' 80' ' ' TYR . 57.3 t -70.2 -36.2 66.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.413 179.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.71 -49.43 58.97 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.204 179.467 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.439 ' CB ' HD21 ' A' ' 55' ' ' LEU . 58.5 m -63.95 -43.6 95.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.982 179.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.43 ' O ' ' HG ' ' A' ' 91' ' ' LEU . 67.3 m -60.98 -50.0 75.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.338 179.329 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -50.3 -43.66 53.76 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.637 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -37.28 86.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.464 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.525 HD23 ' C ' ' A' ' 90' ' ' LEU . 5.9 tt -62.98 -44.14 96.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.929 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.489 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.5 mt -62.63 -48.67 78.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.08 0.466 . . . . 0.0 109.918 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.2 t -57.2 -43.58 82.85 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.645 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.07 -46.17 82.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.797 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.515 ' CD2' HG22 ' A' ' 38' ' ' VAL . 3.4 tp -61.67 -44.97 95.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.827 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.83 -44.86 78.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.775 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -58.4 -48.92 79.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.524 179.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt -55.14 -39.33 69.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.217 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.4 ' HE3' HD22 ' A' ' 41' ' ' LEU . 3.8 mttt -65.02 -54.04 36.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.047 0.451 . . . . 0.0 110.882 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -62.0 -25.46 67.65 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.515 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.81 -47.24 54.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.931 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 58.06 171.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.854 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -111.51 -28.35 8.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.049 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.992 -179.796 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.881 0.372 . . . . 0.0 110.785 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -73.44 130.27 13.22 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.386 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.755 ' HB3' HD12 ' A' ' 21' ' ' LEU . 51.0 Cg_exo -55.53 86.91 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.464 2.109 . . . . 0.0 112.272 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -103.36 56.66 0.59 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.391 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.699 ' O ' HG23 ' A' ' 24' ' ' VAL . 2.1 m -165.91 -41.7 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.806 0.336 . . . . 0.0 110.971 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.755 HD12 ' HB3' ' A' ' 18' ' ' PRO . 17.7 mt -53.85 -32.86 54.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.109 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.507 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.9 p -63.99 -46.78 93.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.1 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.507 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -65.71 -46.76 77.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.06 0.457 . . . . 0.0 110.614 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.816 HG12 HG23 ' A' ' 59' ' ' ILE . 6.3 t -57.0 -44.39 82.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.357 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.4 -38.24 95.41 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.646 -0.788 . . . . 0.0 111.574 179.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.7 -42.92 84.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.973 0.416 . . . . 0.0 110.102 179.232 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.55 ' O ' HD13 ' A' ' 27' ' ' LEU . 1.5 tm? -61.59 -43.73 98.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.105 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.86 -39.54 62.65 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 178.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.83 -36.83 85.59 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.579 178.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.06 -33.1 75.23 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.901 178.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.427 ' HA ' ' CD2' ' A' ' 34' ' ' PHE . 2.2 mp -62.74 -52.54 62.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.284 179.331 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.77 -36.1 71.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.329 179.463 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.438 ' O ' HG23 ' A' ' 37' ' ' VAL . 5.0 tptm -59.63 -44.67 93.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.411 179.508 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.839 ' O ' HG23 ' A' ' 38' ' ' VAL . 11.5 m-85 -60.93 -43.22 98.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.509 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -54.24 -46.7 72.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.793 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -58.73 -51.39 70.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.891 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 33' ' ' LYS . 21.7 t -61.32 -40.24 85.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.992 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.876 HG11 HG21 ' A' ' 48' ' ' VAL . 56.2 t -68.0 -39.76 82.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.93 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.5 t -69.12 -25.19 64.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.929 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.21 -32.21 64.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.391 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.746 HD12 ' O ' ' A' ' 42' ' ' LYS . 1.7 pp -96.39 -21.64 17.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.34 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.746 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.1 OUTLIER 60.62 -174.97 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.039 179.862 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.4 t70 70.82 139.14 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.855 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.729 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 60.71 60.35 8.62 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.269 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.485 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 13.9 mmtp -83.68 -46.01 0.79 Allowed Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 111.398 0.147 . . . . 0.0 111.398 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.485 ' CD ' ' N ' ' A' ' 45' ' ' LYS . 51.9 Cg_exo -53.29 -41.32 73.46 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.322 2.015 . . . . 0.0 112.446 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -67.8 -39.51 83.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.922 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.876 HG21 HG11 ' A' ' 38' ' ' VAL . 33.6 t -70.82 -56.36 11.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.324 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.419 ' O ' ' CG ' ' A' ' 53' ' ' LYS . 15.4 p30 -60.28 -25.33 65.65 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.018 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 7.4 tpp180 -73.55 -43.57 59.58 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.761 0.315 . . . . 0.0 111.405 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.428 ' HA ' ' ND2' ' A' ' 54' ' ' ASN . 3.2 mt-30 -81.31 -44.71 17.26 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.367 0.603 . . . . 0.0 110.0 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.585 HG13 ' O ' ' A' ' 48' ' ' VAL . 2.3 mt -58.09 -40.99 79.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.63 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.474 ' HD3' HD11 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -70.5 -50.8 34.04 Favored 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.954 ' HA ' HD12 ' A' ' 57' ' ' ILE . 30.2 p30 -59.68 -25.42 64.73 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.086 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.726 HD22 HD23 ' A' ' 83' ' ' LEU . 50.7 mt -80.02 -43.95 21.01 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.097 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.6 ' HA ' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -56.75 -34.75 67.87 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.412 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.954 HD12 ' HA ' ' A' ' 54' ' ' ASN . 13.3 mt -71.1 -43.5 75.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.1 178.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.696 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.0 OUTLIER -58.53 -47.35 84.46 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.334 179.422 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.816 HG23 HG12 ' A' ' 24' ' ' VAL . 9.9 mt -58.44 -53.04 52.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.717 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -59.4 -33.85 71.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.624 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.62 -50.43 73.18 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.978 0.418 . . . . 0.0 110.316 179.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.696 HD12 ' O ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -56.32 -54.93 39.6 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.306 179.071 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.497 ' HE1' ' HB ' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -44.89 -57.48 3.75 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.191 -179.87 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.45 -24.87 63.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.957 0.408 . . . . 0.0 110.701 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 24.0 mtpt -82.27 -29.59 31.14 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.577 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -72.79 -35.33 49.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.202 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.01 1.26 57.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.16 -179.101 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.444 ' O ' HG22 ' A' ' 69' ' ' THR . 1.4 m -136.22 21.09 3.2 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.945 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.444 HG22 ' O ' ' A' ' 68' ' ' SER . 1.4 p -160.05 -168.35 2.19 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.949 0.404 . . . . 0.0 110.626 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 5.0 tpt -130.92 37.21 3.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.459 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 33.3 mtp -56.61 139.63 49.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.01 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.8 m -74.53 144.08 44.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.715 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.9 mtt180 -55.04 -30.41 59.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.584 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.88 -44.16 86.5 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.249 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -36.29 79.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.021 179.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.61 ' CD1' HD23 ' A' ' 62' ' ' LEU . 23.0 mm -71.19 -34.06 53.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.368 179.31 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -52.01 67.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.443 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.0 mppp? -61.91 -46.4 89.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.33 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.417 ' OE1' HD11 ' A' ' 62' ' ' LEU . 2.9 mt-10 -56.43 -33.78 66.17 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.901 ' O ' HG23 ' A' ' 84' ' ' VAL . 12.0 t80 -63.54 -37.47 87.44 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -69.59 -36.2 76.03 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.801 178.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.56 -35.6 74.56 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-O 121.136 0.493 . . . . 0.0 109.728 178.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.726 HD23 HD22 ' A' ' 55' ' ' LEU . 1.6 mt -77.13 -31.58 55.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.062 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.901 HG23 ' O ' ' A' ' 80' ' ' TYR . 41.4 t -71.34 -35.03 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.571 179.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.99 -47.32 52.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.598 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.5 m -69.88 -36.86 75.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.709 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.1 m -65.08 -50.46 66.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.697 179.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -39.35 82.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.647 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -65.83 -31.17 71.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.561 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.516 HD23 HD23 ' A' ' 91' ' ' LEU . 6.2 tt -66.67 -48.19 70.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.697 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.516 HD23 HD23 ' A' ' 90' ' ' LEU . 5.8 mt -64.99 -46.64 80.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.168 0.508 . . . . 0.0 109.89 179.331 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.87 -35.43 70.95 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.636 179.553 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.43 -37.61 77.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.669 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.719 HD22 HD21 ' A' ' 41' ' ' LEU . 2.7 mt -71.42 -43.34 66.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.624 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -54.11 48.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.773 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.3 -34.92 77.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.138 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -62.42 -36.6 82.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.525 179.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.408 ' HE3' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -66.46 -53.58 33.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.399 179.595 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -57.85 -25.58 60.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.63 179.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -74.82 -43.87 52.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.762 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 61.41 31.56 19.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.952 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -138.03 173.65 11.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.867 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.804 179.921 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.805 0.336 . . . . 0.0 110.949 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 163.6 -105.52 0.25 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.465 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.49 ' HA ' HD12 ' A' ' 21' ' ' LEU . 63.1 Cg_endo -73.44 -168.04 0.41 Allowed 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.538 2.159 . . . . 0.0 112.248 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.7 -73.87 0.64 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.713 -0.755 . . . . 0.0 112.546 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.3 p -60.17 -29.22 68.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.817 0.342 . . . . 0.0 111.028 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.49 HD12 ' HA ' ' A' ' 18' ' ' PRO . 10.9 mt -58.94 -32.77 69.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.006 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.7 t -61.71 -52.28 62.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.041 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -53.0 -41.24 64.46 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.999 0.428 . . . . 0.0 110.745 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.509 ' CG1' HG23 ' A' ' 59' ' ' ILE . 51.4 t -60.78 -49.73 83.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.332 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.19 -37.54 93.09 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.703 -0.76 . . . . 0.0 111.837 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.01 -46.86 82.02 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.912 0.387 . . . . 0.0 110.26 179.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.752 ' CD2' HD13 ' A' ' 83' ' ' LEU . 22.8 tp -62.01 -37.26 84.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.277 -0.419 . . . . 0.0 109.9 179.04 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.68 -38.89 70.23 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -38.65 88.29 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.672 178.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 20.1 mmt180 -59.8 -38.59 82.35 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.136 -0.483 . . . . 0.0 109.975 179.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.731 HD12 ' CD1' ' A' ' 59' ' ' ILE . 5.9 mt -62.5 -48.7 78.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.048 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.02 -38.06 75.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.087 179.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.41 ' HE3' ' CG2' ' A' ' 37' ' ' VAL . 5.2 tptt -58.9 -42.23 89.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.018 179.197 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.882 ' O ' HG23 ' A' ' 38' ' ' VAL . 21.3 m-85 -61.13 -43.95 98.09 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.25 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -54.56 -43.31 71.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.555 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.79 -52.61 64.99 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.393 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.41 ' CG2' ' HE3' ' A' ' 33' ' ' LYS . 24.0 t -59.31 -37.81 71.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.582 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.882 HG23 ' O ' ' A' ' 34' ' ' PHE . 41.0 t -70.07 -31.2 46.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.895 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.42 -27.64 61.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.593 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.35 -34.4 76.03 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.205 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.745 HD12 ' O ' ' A' ' 42' ' ' LYS . 1.8 pp -92.07 -20.19 21.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.245 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.745 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER 59.19 -173.55 0.1 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.866 0.365 . . . . 0.0 110.898 179.767 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 64.57 151.56 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.805 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.491 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 59.8 29.17 66.9 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.306 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.545 ' HZ1' HG12 ' A' ' 38' ' ' VAL . 0.4 OUTLIER -56.2 -57.55 21.91 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 120.494 0.188 . . . . 0.0 111.252 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 11.3 Cg_endo -54.96 -33.88 84.39 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.436 2.09 . . . . 0.0 112.228 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -67.07 -49.06 66.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.705 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.87 HG21 HG11 ' A' ' 38' ' ' VAL . 25.8 t -69.93 -55.17 15.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.95 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.595 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 65.3 m-20 -52.85 -32.87 46.92 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.684 0.278 . . . . 0.0 111.106 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.6 ttt85 -72.15 -46.21 57.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.869 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.45 ' NE2' HD12 ' A' ' 90' ' ' LEU . 9.3 pt20 -73.04 -45.59 56.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.657 0.741 . . . . 0.0 109.472 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.538 HG13 HG12 ' A' ' 48' ' ' VAL . 1.7 mt -57.56 -32.89 43.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.314 178.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.826 ' HD2' HD11 ' A' ' 57' ' ' ILE . 7.1 tmtm? -69.16 -49.8 53.49 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.343 178.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.946 ' HA ' HD12 ' A' ' 57' ' ' ILE . 16.9 m-20 -50.98 -39.84 56.43 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.578 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.674 ' HB3' HD11 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -71.17 -43.01 68.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.182 179.345 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.603 ' HG2' HD13 ' A' ' 31' ' ' LEU . 13.3 mm-40 -57.01 -36.79 70.84 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 178.385 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.946 HD12 ' HA ' ' A' ' 54' ' ' ASN . 12.2 mt -69.63 -42.1 80.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.173 178.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.655 ' O ' HD12 ' A' ' 62' ' ' LEU . 22.7 t -57.62 -51.52 69.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.192 179.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.731 ' CD1' HD12 ' A' ' 31' ' ' LEU . 5.9 mt -57.92 -46.49 87.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.281 179.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.8 -35.24 75.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.351 179.446 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.92 -49.81 75.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.283 179.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.657 HD23 ' CD1' ' A' ' 76' ' ' ILE . 1.6 mp -55.53 -54.0 49.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.439 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.42 ' HA ' HG12 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -45.15 -54.3 7.02 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.291 -179.907 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.95 -25.22 67.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.863 0.363 . . . . 0.0 110.685 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 25.0 mtpt -82.04 -28.66 32.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.565 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.656 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.7 mm -73.06 -38.06 54.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.43 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.15 -27.57 16.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.715 -179.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.78 ' O ' HG23 ' A' ' 69' ' ' THR . 1.4 m -105.88 25.33 11.03 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.78 HG23 ' O ' ' A' ' 68' ' ' SER . 0.3 OUTLIER 174.14 155.12 0.12 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.878 179.678 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.6 mmt -83.23 82.44 8.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.946 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -84.18 119.03 24.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.054 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.7 m -73.43 144.34 46.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.607 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -52.65 -34.07 49.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.948 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -58.25 -49.09 78.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.47 179.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.32 -34.35 72.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.179 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.843 HG22 ' CE2' ' A' ' 80' ' ' TYR . 21.9 mm -72.4 -34.19 47.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.574 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' ' 80' ' ' TYR . 3.2 tp-100 -60.54 -48.58 81.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.519 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.71 -45.74 85.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.35 179.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.91 -35.99 69.65 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 178.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.918 ' O ' HG23 ' A' ' 84' ' ' VAL . 9.5 m-85 -63.59 -35.08 79.31 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 177.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -68.92 -36.76 78.36 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.831 178.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.09 -35.16 76.25 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.261 0.553 . . . . 0.0 109.573 178.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.752 HD13 ' CD2' ' A' ' 27' ' ' LEU . 1.9 mt -76.56 -31.96 57.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.035 178.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.918 HG23 ' O ' ' A' ' 80' ' ' TYR . 49.3 t -69.15 -34.16 62.02 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.362 179.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.9 mmpt? -72.03 -49.12 39.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.426 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 m -68.27 -37.52 80.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.609 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 98.7 p -67.06 -49.08 66.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.663 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -55.88 -43.96 77.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.975 0.417 . . . . 0.0 110.779 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -67.29 -30.67 70.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.729 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.45 HD12 ' NE2' ' A' ' 51' ' ' GLN . 7.1 tt -63.17 -47.63 81.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.018 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.647 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.4 mt -63.54 -47.2 82.57 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.215 0.531 . . . . 0.0 109.84 179.383 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 49.4 m -58.31 -42.93 87.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.505 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.77 -33.49 75.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.566 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.634 HD11 HG13 ' A' ' 38' ' ' VAL . 11.9 tp -67.59 -49.18 64.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.669 179.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.426 ' O ' ' HG2' ' A' ' 98' ' ' LYS . 2.5 mp0 -55.75 -47.0 77.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.597 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.1 pttp -65.34 -28.74 69.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.03 0.443 . . . . 0.0 109.825 178.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -70.41 -53.93 14.47 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.177 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.426 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 0.0 OUTLIER -64.07 -41.23 97.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.846 0.355 . . . . 0.0 110.929 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -64.69 -33.69 76.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.672 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -78.09 -28.83 48.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.132 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -52.81 102.15 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.098 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -119.87 -27.42 5.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.277 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.176 -179.83 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.88 0.371 . . . . 0.0 110.796 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -72.12 -170.06 13.58 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.601 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -55.73 -61.85 0.32 Allowed 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.661 2.241 . . . . 0.0 112.295 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.58 -78.97 1.79 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.602 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.9 p -105.49 -26.39 11.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.74 0.305 . . . . 0.0 110.993 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.487 HD21 ' HB ' ' A' ' 66' ' ' ILE . 3.5 mt -55.11 -32.5 62.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.165 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.5 HG13 ' N ' ' A' ' 23' ' ' LYS . 10.5 p -51.78 -46.99 40.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.36 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.5 ' N ' HG13 ' A' ' 22' ' ' VAL . 0.5 OUTLIER -63.69 -43.83 95.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.14 0.495 . . . . 0.0 110.371 179.687 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.523 ' CG1' HG23 ' A' ' 59' ' ' ILE . 21.1 t -57.61 -44.47 85.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.492 179.357 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.16 -38.57 96.38 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.716 179.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.82 -46.06 81.88 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.079 0.466 . . . . 0.0 110.096 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.871 HD23 HG12 ' A' ' 59' ' ' ILE . 9.5 tp -62.12 -37.19 84.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.883 178.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.56 -38.77 69.76 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.671 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -38.01 84.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.706 178.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -61.22 -37.17 82.07 Favored 'General case' 0 N--CA 1.458 -0.068 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.178 179.336 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.655 HD23 HD11 ' A' ' 59' ' ' ILE . 2.6 mm? -63.91 -52.19 61.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.174 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.04 -32.43 67.97 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.303 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.6 tptt -63.07 -45.13 93.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.326 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.848 ' O ' HG23 ' A' ' 38' ' ' VAL . 13.3 m-85 -60.4 -43.4 96.7 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.59 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -57.33 -42.64 82.31 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.726 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.01 -52.45 65.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.715 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.42 ' O ' HD23 ' A' ' 41' ' ' LEU . 21.7 t -60.95 -37.95 78.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.871 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.924 HG22 HD21 ' A' ' 94' ' ' LEU . 56.1 t -70.09 -32.77 52.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.037 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -72.68 -29.32 63.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.861 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.05 -28.73 64.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.21 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.867 HD12 ' O ' ' A' ' 42' ' ' LYS . 2.2 pp -101.49 -24.25 14.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.202 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.867 ' O ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER 60.49 -169.7 0.15 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.816 179.88 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 64.51 136.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.76 -179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.887 ' O ' HG23 ' A' ' 48' ' ' VAL . . . 72.2 26.16 72.84 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.327 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.564 ' N ' ' HD2' ' A' ' 46' ' ' PRO . 1.9 mmtt -56.53 -55.72 39.73 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.52 0.2 . . . . 0.0 111.354 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.564 ' HD2' ' N ' ' A' ' 45' ' ' LYS . 9.8 Cg_endo -53.49 -44.15 51.48 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.348 2.032 . . . . 0.0 112.275 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.88 -49.45 77.41 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.034 0.445 . . . . 0.0 110.511 179.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 44' ' ' GLY . 17.8 t -60.9 -55.28 25.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.756 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.412 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 42.5 m-20 -54.83 -25.61 29.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.115 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -50.41 28.63 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.843 0.354 . . . . 0.0 111.555 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -74.89 -45.17 44.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.496 0.665 . . . . 0.0 109.398 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.699 HG12 HD11 ' A' ' 90' ' ' LEU . 1.5 mt -57.81 -32.35 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.276 178.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.572 ' HG2' HD11 ' A' ' 57' ' ' ILE . 26.9 tttt -69.35 -52.75 24.19 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.429 179.242 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.938 ' HA ' HD12 ' A' ' 57' ' ' ILE . 22.1 m-20 -50.95 -39.3 54.64 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.743 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 1.041 HD13 HD23 ' A' ' 83' ' ' LEU . 0.3 OUTLIER -70.65 -43.68 68.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.283 179.592 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.72 -35.87 69.04 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.53 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.938 HD12 ' HA ' ' A' ' 54' ' ' ASN . 11.9 mt -71.12 -42.56 75.9 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.31 178.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.838 ' O ' HD12 ' A' ' 62' ' ' LEU . 1.1 m -58.89 -49.68 76.88 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.406 179.5 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.871 HG12 HD23 ' A' ' 27' ' ' LEU . 36.0 mt -60.79 -53.49 48.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.552 179.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.84 -34.69 71.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.503 179.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.67 -49.7 75.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.269 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.838 HD12 ' O ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -55.76 -54.67 41.53 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.405 179.186 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.463 ' HE1' ' HB ' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -45.0 -58.08 3.41 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.218 -179.899 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.17 -24.53 63.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.881 0.372 . . . . 0.0 110.552 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.442 ' O ' HG23 ' A' ' 69' ' ' THR . 0.0 OUTLIER -82.14 -29.44 31.62 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.633 179.496 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.646 HG12 ' O ' ' A' ' 62' ' ' LEU . 1.5 mm -73.0 -34.84 47.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.278 -179.443 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -87.61 -28.28 22.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.973 -179.163 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.485 ' O ' HG22 ' A' ' 69' ' ' THR . 48.0 t -101.31 17.63 22.1 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.485 HG22 ' O ' ' A' ' 68' ' ' SER . 0.8 OUTLIER -161.46 -168.02 1.89 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.612 179.376 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.83 39.06 3.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.232 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -51.66 152.7 2.68 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.328 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.7 m -86.12 147.41 26.17 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.803 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -30.93 65.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.585 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -46.28 88.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.282 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -60.42 -33.77 73.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.368 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.595 ' CD1' HD23 ' A' ' 62' ' ' LEU . 23.0 mm -71.07 -35.13 57.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.46 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -62.39 -45.46 93.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.562 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.8 tptp -67.01 -49.03 66.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.449 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.541 ' O ' HD12 ' A' ' 83' ' ' LEU . 49.5 mt-10 -56.73 -34.1 67.18 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.919 ' O ' HG23 ' A' ' 84' ' ' VAL . 15.4 t80 -64.8 -35.64 81.73 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.42 -0.955 . . . . 0.0 108.42 177.669 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.52 -36.92 76.86 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.896 178.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.23 -36.87 78.71 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 178.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 1.041 HD23 HD13 ' A' ' 55' ' ' LEU . 1.3 mt -75.75 -31.75 59.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.944 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.919 HG23 ' O ' ' A' ' 80' ' ' TYR . 87.9 t -67.13 -34.17 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.23 179.292 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 16.2 tptt -72.13 -49.36 36.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.095 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.477 ' HB3' HD11 ' A' ' 55' ' ' LEU . 1.1 t -61.78 -40.84 96.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.323 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.7 p -64.41 -48.95 73.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.438 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.91 -44.04 49.93 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.595 179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.18 -29.72 66.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.564 179.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.699 HD11 HG12 ' A' ' 52' ' ' ILE . 9.1 tt -65.43 -48.96 70.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.807 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.492 HD21 ' CE1' ' A' ' 34' ' ' PHE . 6.6 mt -62.33 -45.63 92.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.203 0.525 . . . . 0.0 109.665 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 60.3 p -54.79 -42.94 72.4 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.382 179.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.06 -45.23 94.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.43 179.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.924 HD21 HG22 ' A' ' 38' ' ' VAL . 0.5 OUTLIER -54.93 -49.11 72.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.239 179.442 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -56.4 -38.69 71.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.414 179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.62 -32.27 73.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.029 179.14 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -69.55 -58.18 4.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.249 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.55 -45.87 88.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.343 -179.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -62.88 -35.85 81.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.865 0.364 . . . . 0.0 110.875 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -70.43 -52.91 18.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.904 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -60.99 -72.4 0.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.864 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -94.13 -177.57 4.34 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.834 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.723 179.987 . . . . . . . . 0 0 . 1 stop_ save_