data_1ztr_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 1ztr _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 ' 23' ' ' ASN . . . . . 0.412 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--O 1.23 0.056 0 CA-C-O 121.16 0.505 . . . . 0.0 110.167 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.2 tpp180 -126.17 -35.59 2.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.228 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.584 ' CE1' HD21 ' A' ' 26' ' ' LEU . 20.5 p90 -100.58 -46.18 5.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.702 -178.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.584 HD21 ' CE1' ' A' ' 25' ' ' TYR . 0.3 OUTLIER -48.69 -29.84 4.87 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.43 0.633 . . . . 0.0 110.0 -179.939 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.433 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.8 OUTLIER -55.2 -24.71 28.58 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.886 178.617 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.82 8.73 5.32 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.462 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.428 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.9 OUTLIER -112.58 -50.83 2.87 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.828 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.428 ' HD3' ' CB ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -119.93 -7.33 9.96 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.69 -179.797 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.433 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 10.2 ttt180 -53.44 -33.59 54.65 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.109 0.48 . . . . 0.0 110.389 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -74.03 -29.69 62.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.508 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.496 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -72.59 -38.95 67.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.461 179.807 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.693 ' HB3' ' CZ3' ' A' ' 48' ' ' TRP . 6.7 mt -70.86 -62.12 1.51 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.9 t -46.48 -29.45 1.76 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.913 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.9 m -73.81 -47.98 34.75 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.163 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.85 -10.7 56.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.024 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.671 ' HG ' ' CZ2' ' A' ' 48' ' ' TRP . 2.2 mm? -89.32 -27.73 20.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.661 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.64 65.51 3.38 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.925 -179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.559 ' C ' HD11 ' A' ' 40' ' ' LEU . 1.3 pp -157.34 -162.89 1.27 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.978 0.418 . . . . 0.0 111.312 -179.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.526 ' O ' HG12 ' A' ' 45' ' ' ILE . 19.4 m-20 -123.07 -177.68 3.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.611 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -58.36 -24.43 59.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.962 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.47 -4.9 33.14 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.623 ' NE2' ' N ' ' A' ' 44' ' ' GLN . 0.9 OUTLIER -120.84 -25.7 5.37 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.951 0.405 . . . . 0.0 109.959 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.692 HD11 ' CZ2' ' A' ' 48' ' ' TRP . 14.7 mm -57.36 -59.35 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.913 0 CA-C-O 121.661 0.743 . . . . 0.0 109.148 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.498 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 0.2 OUTLIER -55.75 -29.42 59.52 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.528 -1.215 . . . . 0.0 110.144 179.612 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.493 ' HB ' ' O ' ' A' ' 44' ' ' GLN . 1.3 mp -59.39 -32.79 49.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.682 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.693 ' CZ3' ' HB3' ' A' ' 34' ' ' LEU . 1.5 m0 -69.97 -63.9 0.99 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.522 0.677 . . . . 0.0 110.112 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.549 ' CZ ' HG22 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -62.31 -28.22 69.58 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.561 -179.441 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.498 ' CB ' ' O ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -62.96 -32.96 74.4 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 178.86 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.022 178.979 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.599 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 121.503 0.668 . . . . 0.0 110.616 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.37 -35.51 7.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.572 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.521 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.7 p90 -92.19 -44.34 8.83 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.926 -1.033 . . . . 0.0 111.767 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.599 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.3 OUTLIER -46.32 -27.33 1.01 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.315 0.579 . . . . 0.0 110.969 -179.13 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.1 p -58.57 -19.73 40.68 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.105 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -123.85 -17.72 6.23 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.438 178.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.416 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 4.6 tmt_? -96.21 -53.08 3.75 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-O 120.948 0.404 . . . . 0.0 110.503 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.496 ' HB2' ' HB2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -82.41 -27.82 31.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.392 179.438 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.434 ' HA ' HD11 ' A' ' 34' ' ' LEU . 27.4 ttt180 -49.77 -29.91 8.59 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 178.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -77.62 -32.48 53.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.383 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.511 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.2 OUTLIER -77.84 -40.43 40.32 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.537 179.621 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.614 ' HB3' ' CH2' ' A' ' 48' ' ' TRP . 1.5 mt -63.14 -54.05 43.78 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.082 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.538 ' HA ' HD11 ' A' ' 40' ' ' LEU . 6.1 t -41.72 -30.8 0.25 Allowed 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.734 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.3 m -120.52 14.97 11.99 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.443 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -105.85 -45.25 4.42 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.782 0.289 . . . . 0.0 111.782 -179.871 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.631 ' HG ' ' CD1' ' A' ' 40' ' ' LEU . 0.5 OUTLIER -103.34 14.62 31.1 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -179.114 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.11 69.4 1.29 Allowed Glycine 0 CA--C 1.509 -0.343 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.577 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.631 ' CD1' ' HG ' ' A' ' 38' ' ' LEU . 0.9 OUTLIER -101.25 -164.91 1.15 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.859 0.362 . . . . 0.0 111.873 -179.251 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.4 ' H ' ' NE2' ' A' ' 44' ' ' GLN . 9.5 t30 -126.55 16.55 7.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.038 -178.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.42 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 0.7 OUTLIER 66.9 7.81 5.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.67 0.271 . . . . 0.0 111.28 -179.841 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.62 -29.64 5.7 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.953 0.406 . . . . 0.0 110.533 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.499 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -88.43 -4.32 58.66 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.879 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.681 ' HA ' ' CZ2' ' A' ' 48' ' ' TRP . 9.1 mm -60.41 -58.78 5.8 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.05 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.904 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.488 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 13.8 pttt -62.17 -19.32 62.96 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.909 -1.041 . . . . 0.0 109.631 178.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.499 ' HB ' ' O ' ' A' ' 44' ' ' GLN . 1.7 mp -67.34 -34.89 71.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.681 ' CZ2' ' HA ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -69.82 -60.21 2.45 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 119.903 -0.719 . . . . 0.0 110.238 179.832 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.562 ' CZ ' ' CE3' ' A' ' 48' ' ' TRP . 1.4 m-85 -57.73 -29.78 65.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.385 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.488 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -51.79 -29.83 20.64 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.084 0.469 . . . . 0.0 110.074 178.94 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.612 179.652 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.508 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.522 -0.12 0 CA-C-O 121.295 0.569 . . . . 0.0 109.715 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -121.83 -38.75 2.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.821 -178.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.45 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 13.0 p90 -89.95 -39.01 13.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.545 -178.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.508 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 1.0 OUTLIER -53.05 -14.63 0.64 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 121.107 0.48 . . . . 0.0 111.089 -179.742 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.441 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -77.5 -20.43 54.31 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.811 179.52 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -133.98 14.18 3.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.116 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.41 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -118.53 -42.73 2.74 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.821 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.72 9.61 3.36 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.411 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.405 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 1.7 ttm180 -71.59 -46.28 59.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.899 0.38 . . . . 0.0 110.624 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -61.95 -27.89 69.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.887 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.481 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -74.73 -39.46 61.86 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.594 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.619 ' HB3' ' CH2' ' A' ' 48' ' ' TRP . 9.8 mt -69.13 -58.49 4.0 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.479 ' HA ' HD23 ' A' ' 40' ' ' LEU . 1.7 t -40.11 -33.22 0.21 Allowed 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.271 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.4 m -77.24 -39.02 49.92 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.303 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -91.18 -9.21 46.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.629 -179.765 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.556 ' HG ' ' CE2' ' A' ' 48' ' ' TRP . 4.3 mm? -99.03 2.93 46.68 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.607 0.242 . . . . 0.0 111.451 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 46.84 70.14 0.74 Allowed Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.992 -0.623 . . . . 0.0 113.072 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.643 ' HB2' ' HB2' ' A' ' 44' ' ' GLN . 1.8 pt? -156.66 -151.45 0.32 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.295 0.569 . . . . 0.0 111.659 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -136.55 -89.49 0.29 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.098 -0.956 . . . . 0.0 111.615 -179.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.414 ' HA ' HG13 ' A' ' 45' ' ' ILE . 14.0 mm-40 -136.97 -46.46 0.58 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.776 0.322 . . . . 0.0 111.605 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.11 -19.15 65.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.751 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.739 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -95.61 -17.07 21.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.973 0.416 . . . . 0.0 110.082 179.838 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.763 HD11 ' CH2' ' A' ' 48' ' ' TRP . 8.3 mm -54.66 -49.48 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 178.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -66.38 -11.11 49.61 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.913 177.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.739 ' HB ' ' O ' ' A' ' 44' ' ' GLN . 1.3 mp -73.67 -33.29 38.05 Favored 'Isoleucine or valine' 0 C--N 1.343 0.29 0 C-N-CA 121.034 -0.266 . . . . 0.0 111.553 -179.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.763 ' CH2' HD11 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -69.11 -60.1 2.58 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.312 179.661 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.626 ' CZ ' ' CE3' ' A' ' 48' ' ' TRP . 1.3 m-85 -57.16 -33.27 67.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.695 -179.282 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.89 -30.15 61.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.08 0.467 . . . . 0.0 109.854 179.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.997 179.205 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.444 ' O ' ' CG ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER . . . . . 0 CA--C 1.538 0.515 0 CA-C-O 120.89 0.376 . . . . 0.0 111.294 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.426 ' O ' ' CG2' ' A' ' 27' ' ' THR . 12.1 mtt180 -133.28 -55.95 0.91 Allowed 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.161 0.505 . . . . 0.0 110.69 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.485 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 1.3 p90 -37.78 -34.37 0.11 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.277 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.485 ' N ' ' CD1' ' A' ' 25' ' ' TYR . 2.2 pt? -51.58 -28.67 14.69 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.206 -178.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.454 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 2.5 p -70.83 -14.96 62.6 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.972 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -136.92 15.68 3.07 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.09 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' A' ' 25' ' ' TYR . 16.4 tpt85 -121.62 -48.07 2.18 Favored 'General case' 0 C--O 1.23 0.055 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.579 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.91 -14.28 8.96 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.553 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.454 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 1.7 ttm180 -56.92 -22.49 37.96 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.672 0.273 . . . . 0.0 110.968 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -84.11 -25.17 29.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.048 0.451 . . . . 0.0 109.98 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.91 -44.09 15.77 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.044 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.566 HD22 ' CH2' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -64.35 -59.52 4.27 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 178.788 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.1 t -39.13 -33.04 0.11 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.374 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 12.9 m -78.88 -28.35 44.1 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.163 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 34' ' ' LEU . 3.0 tt0 -73.42 -60.63 2.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.877 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.592 HD21 HD13 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -56.57 -49.77 73.88 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 121.05 0.453 . . . . 0.0 110.329 179.756 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 108.95 46.26 0.96 Allowed Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.721 -179.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.592 HD13 HD21 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -130.17 -160.38 1.03 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.113 0.482 . . . . 0.0 111.413 -179.322 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -118.69 -88.76 0.61 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.675 -0.693 . . . . 0.0 112.068 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -141.04 -46.14 0.39 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.76 0.314 . . . . 0.0 111.1 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.432 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -65.98 -12.89 58.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.165 179.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.491 ' H ' ' NE2' ' A' ' 44' ' ' GLN . 0.3 OUTLIER -101.14 -20.27 15.39 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.485 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.767 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 41.9 mm -57.58 -60.58 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.482 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -58.02 -16.79 13.9 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.704 178.958 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.432 ' CD1' ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -77.37 -36.08 23.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -178.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.767 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -78.8 -31.69 46.07 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 118.653 -1.219 . . . . 0.0 111.777 -179.354 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.735 ' CE1' ' CZ3' ' A' ' 48' ' ' TRP . 4.9 m-85 -65.54 -42.49 91.88 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.064 178.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.42 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 6.5 pt20 -61.18 -28.4 69.11 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.741 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 . . . . . 0 N--CA 1.452 -0.326 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.949 178.761 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.459 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.7 OUTLIER . . . . . 0 CA--C 1.529 0.137 0 CA-C-O 120.851 0.358 . . . . 0.0 111.385 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.413 ' O ' HG22 ' A' ' 27' ' ' THR . 0.0 OUTLIER -124.91 -38.5 2.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.308 0.575 . . . . 0.0 111.0 -179.548 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.476 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 15.9 p90 -83.54 -40.7 18.81 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.0 -179.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.476 ' N ' ' CG ' ' A' ' 25' ' ' TYR . 2.2 pt? -47.76 -28.22 2.4 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.357 0.598 . . . . 0.0 110.536 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.414 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 1.2 p -58.2 -23.91 57.29 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.783 178.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -130.31 21.39 5.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.703 178.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.54 -51.24 1.38 Allowed 'General case' 0 C--O 1.231 0.087 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.94 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -131.26 4.29 4.36 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.855 -179.681 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 26' ' ' LEU . 2.9 ttt180 -58.61 -26.42 63.66 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.871 0.367 . . . . 0.0 110.667 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.94 -21.11 34.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.055 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.95 -37.95 15.97 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.635 -0.712 . . . . 0.0 109.52 179.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.515 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 0.5 OUTLIER -65.37 -49.27 69.95 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.672 178.97 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.91 -27.09 1.97 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.092 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.99 -11.9 27.66 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.601 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.403 ' N ' ' O ' ' A' ' 34' ' ' LEU . 9.6 tp10 -76.91 -62.51 1.62 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.638 0.256 . . . . 0.0 110.955 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.483 HD23 ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -69.15 -47.63 64.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.187 0.518 . . . . 0.0 110.177 179.528 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 124.68 2.54 8.03 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.501 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.456 HD23 ' CD1' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -102.15 -165.42 1.18 Allowed 'General case' 0 CA--C 1.527 0.093 0 CA-C-O 121.095 0.474 . . . . 0.0 111.396 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.514 ' O ' HG12 ' A' ' 45' ' ' ILE . 17.4 t30 -113.76 166.91 11.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.314 -179.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.524 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 91.4 mt-10 -53.07 -28.31 24.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.479 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.412 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -63.82 -48.92 74.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.982 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.491 ' HA ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -87.11 -15.09 39.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.225 179.414 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.948 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 2.5 mm -59.94 -58.62 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.529 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 0.2 OUTLIER -57.32 -18.15 15.66 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.1 178.012 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.491 ' HB ' ' HA ' ' A' ' 44' ' ' GLN . 1.2 mp -79.39 -48.39 21.14 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 -178.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.948 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 34.0 p-90 -63.91 -25.84 68.33 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 119.392 -0.923 . . . . 0.0 112.177 -177.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.661 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 27.5 m-85 -66.33 -53.1 40.17 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 177.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.423 ' CG ' ' O ' ' A' ' 47' ' ' ILE . 1.7 pt20 -53.03 -26.49 15.86 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.252 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.024 178.963 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.503 ' HA ' ' CG ' ' A' ' 26' ' ' LEU . 1.7 m-80 . . . . . 0 CA--C 1.519 -0.227 0 CA-C-O 121.514 0.673 . . . . 0.0 109.784 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.6 -20.68 15.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.275 -179.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.514 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 12.4 p90 -116.26 -44.6 2.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.487 -178.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.514 ' N ' ' CG ' ' A' ' 25' ' ' TYR . 0.5 OUTLIER -48.98 -27.11 2.91 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.304 0.574 . . . . 0.0 110.382 -179.811 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -59.53 -24.0 63.32 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.839 178.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -130.93 0.29 4.25 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.996 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.85 -29.54 6.35 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.988 0.423 . . . . 0.0 110.997 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.5 ' HB3' ' HB2' ' A' ' 26' ' ' LEU . 6.6 ttm180 -115.89 -24.39 8.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.895 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 26' ' ' LEU . 32.4 ttp180 -49.47 -31.57 10.25 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.188 0.518 . . . . 0.0 110.161 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -38.29 73.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.973 179.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.453 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.6 OUTLIER -78.02 -37.11 47.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.94 179.219 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.6 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 4.0 mt -67.41 -41.73 84.4 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.519 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.413 ' N ' HD11 ' A' ' 45' ' ' ILE . 3.4 t -55.66 -26.92 47.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.649 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -112.05 3.13 17.17 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.101 179.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -85.57 -48.03 9.31 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.024 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.59 HD12 HD11 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -96.34 -31.92 12.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.797 0.332 . . . . 0.0 110.479 179.645 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 104.31 46.28 1.35 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.546 -0.835 . . . . 0.0 113.315 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.59 HD11 HD12 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -127.25 -163.95 1.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.979 0.419 . . . . 0.0 111.331 179.227 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.413 ' O ' HG12 ' A' ' 45' ' ' ILE . 1.0 OUTLIER -97.96 148.64 23.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.017 -179.176 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -53.77 -40.45 66.27 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.099 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.96 -31.12 65.99 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 121.755 0.788 . . . . 0.0 109.247 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.502 ' NE2' HD22 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -77.73 -14.82 59.49 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.177 -1.374 . . . . 0.0 110.273 -179.832 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.804 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 5.9 mm -63.29 -57.19 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.46 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -58.39 -16.53 15.14 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.917 177.795 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.472 ' O ' ' HG2' ' A' ' 50' ' ' GLN . 1.2 mp -79.39 -39.64 20.98 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.143 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -178.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.804 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 27.1 p-90 -74.06 -27.54 60.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 118.732 -1.187 . . . . 0.0 112.319 -178.06 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.649 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 7.4 m-85 -68.48 -46.29 70.1 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.9 pt20 -60.54 -25.6 66.26 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.829 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 . . . . . 0 N--CA 1.453 -0.322 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.985 178.742 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.494 ' ND2' ' N ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.219 0 CA-C-O 120.778 0.323 . . . . 0.0 110.27 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.75 -44.1 1.68 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.117 0.484 . . . . 0.0 110.905 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.538 ' CE1' HD23 ' A' ' 26' ' ' LEU . 15.4 p90 -93.35 -45.94 7.58 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.096 -179.112 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.538 HD23 ' CE1' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -51.16 -27.28 8.29 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.325 0.583 . . . . 0.0 110.124 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.4 p -59.52 -21.87 60.82 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.94 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -131.37 1.32 4.14 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.712 178.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -115.91 -31.59 5.71 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 120.948 0.404 . . . . 0.0 111.009 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.417 ' HB3' ' HB2' ' A' ' 26' ' ' LEU . 4.8 ttt85 -117.57 -23.62 7.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.275 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.429 ' N ' ' O ' ' A' ' 26' ' ' LEU . 34.7 ttp180 -50.74 -30.06 12.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.045 0.45 . . . . 0.0 110.615 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.46 -31.1 62.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.338 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.475 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.3 OUTLIER -75.86 -37.53 58.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.408 179.615 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.653 ' HB3' ' CH2' ' A' ' 48' ' ' TRP . 6.9 mt -68.29 -62.7 1.28 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 39.5 t -43.06 -30.17 0.41 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.196 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.6 t -79.18 -38.72 35.18 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.265 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.64 -15.81 31.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.074 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.687 ' HG ' ' CZ2' ' A' ' 48' ' ' TRP . 2.7 mm? -88.98 -27.58 20.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.631 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 58.91 65.52 3.43 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.719 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.556 ' HG ' ' HB3' ' A' ' 38' ' ' LEU . 0.5 OUTLIER -154.66 -164.78 1.9 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.993 0.425 . . . . 0.0 111.577 -178.889 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.449 ' O ' ' NE2' ' A' ' 44' ' ' GLN . 35.5 t30 -118.97 172.07 7.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.321 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.4 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 5.5 mt-10 -53.39 -23.53 9.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.678 0.275 . . . . 0.0 111.469 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.415 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -70.1 -9.45 55.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.933 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.622 ' NE2' ' N ' ' A' ' 44' ' ' GLN . 1.1 mp0 -117.32 -26.65 6.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.053 0.454 . . . . 0.0 109.78 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.712 HD13 ' CZ2' ' A' ' 48' ' ' TRP . 12.9 mm -57.41 -59.26 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.417 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -55.9 -25.54 43.33 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.129 179.281 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.544 ' HB ' ' O ' ' A' ' 44' ' ' GLN . 1.2 mp -62.89 -32.51 56.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.748 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.712 ' CZ2' HD13 ' A' ' 45' ' ' ILE . 1.1 m0 -70.89 -63.93 1.0 Allowed 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.523 0.678 . . . . 0.0 110.229 179.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.515 ' CZ ' ' CE3' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -61.97 -24.22 66.88 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.82 -179.244 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.3 mt-30 -56.88 -29.15 62.68 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.211 179.344 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.675 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.186 0 CA-C-O 121.568 0.699 . . . . 0.0 110.677 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -93.66 -48.69 6.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.175 179.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.511 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 10.8 p90 -70.69 -43.84 68.21 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.682 -1.144 . . . . 0.0 111.696 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.675 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 1.2 pp -53.87 -20.64 6.23 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.201 0.524 . . . . 0.0 110.754 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.487 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 3.3 p -65.82 -19.06 65.75 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.037 178.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -135.08 16.29 3.5 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.726 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.5 -51.41 2.4 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.639 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.507 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -132.81 7.88 4.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.467 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.487 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 47.3 ttt180 -80.06 -2.37 44.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.903 0.382 . . . . 0.0 110.867 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -97.59 -28.91 13.73 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -69.78 -35.33 74.8 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.56 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.658 ' HB3' ' CH2' ' A' ' 48' ' ' TRP . 0.3 OUTLIER -66.31 -63.87 0.98 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.446 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.451 ' HB2' HD12 ' A' ' 45' ' ' ILE . 17.8 t -40.3 -31.79 0.15 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.943 -1.026 . . . . 0.0 111.539 179.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.47 -36.98 21.91 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.946 -179.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -85.09 -19.37 31.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.894 0.378 . . . . 0.0 111.07 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.5 ' HB2' HD13 ' A' ' 40' ' ' LEU . 4.4 mm? -78.3 -49.98 12.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.779 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 104.48 21.22 9.45 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.718 -0.673 . . . . 0.0 111.818 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.5 HD13 ' HB2' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -109.02 -160.54 0.72 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.163 0.506 . . . . 0.0 111.101 -179.847 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -120.84 -101.04 0.42 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.486 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -129.63 -42.62 1.29 Allowed 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.722 0.296 . . . . 0.0 111.516 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.404 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -73.36 -2.78 23.58 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.763 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.506 ' NE2' ' N ' ' A' ' 44' ' ' GLN . 0.9 OUTLIER -106.02 -23.29 12.68 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.407 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.667 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 38.5 mm -56.8 -61.21 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.869 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -15.37 11.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.796 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.432 ' HB ' ' HA ' ' A' ' 44' ' ' GLN . 1.4 mp -79.11 -36.19 18.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -178.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.707 ' CZ3' ' CE1' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -78.68 -29.65 45.74 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 118.463 -1.295 . . . . 0.0 111.902 -179.155 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.707 ' CE1' ' CZ3' ' A' ' 48' ' ' TRP . 4.5 m-85 -69.41 -42.19 75.4 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 119.683 -0.807 . . . . 0.0 109.187 178.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.429 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 5.8 pt20 -60.81 -28.77 69.03 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.968 179.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.056 178.916 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.518 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.136 0 CA-C-O 121.311 0.577 . . . . 0.0 109.855 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.66 -40.74 2.31 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.625 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.428 ' C ' ' H ' ' A' ' 27' ' ' THR . 7.9 p90 -89.91 -36.71 14.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.292 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.518 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -54.05 -11.48 0.46 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.092 0.473 . . . . 0.0 111.183 -179.889 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.46 ' N ' HD22 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -81.82 -20.67 38.57 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.779 179.654 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -132.97 11.38 4.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.107 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.04 -42.11 2.04 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.809 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.4 ' HD3' ' CB ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -112.44 -14.82 13.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.362 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 ttm180 -51.78 -30.84 24.52 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.069 0.461 . . . . 0.0 110.399 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.3 -48.05 18.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.17 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.406 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -61.3 -33.52 73.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.231 0.538 . . . . 0.0 109.817 179.2 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.653 HD21 ' CZ2' ' A' ' 48' ' ' TRP . 5.1 mt -67.88 -57.27 6.52 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.515 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.46 -23.72 10.91 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.244 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.97 -27.67 23.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.387 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -111.08 29.49 7.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.785 0.326 . . . . 0.0 111.286 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.477 ' HB3' ' CD1' ' A' ' 40' ' ' LEU . 1.0 OUTLIER -132.7 -56.33 0.94 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.239 0.542 . . . . 0.0 110.673 179.75 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 121.11 3.28 10.75 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.494 -0.776 . . . . 0.0 112.009 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.501 ' HB3' ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -94.22 -158.66 0.64 Allowed 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.329 0.585 . . . . 0.0 111.234 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -119.06 -59.82 1.81 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.494 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 174.72 -42.2 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.432 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -72.52 -12.04 60.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.288 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.548 ' H ' ' NE2' ' A' ' 44' ' ' GLN . 1.4 mp0 -101.28 -15.78 17.17 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.911 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 2.7 mm -63.02 -58.74 6.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.765 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.457 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.46 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 2.6 mtmt -56.97 -19.09 16.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.047 178.028 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.526 ' O ' ' HG2' ' A' ' 50' ' ' GLN . 1.2 mp -78.12 -47.25 25.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 113.75 1.019 . . . . 0.0 113.75 -178.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.911 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 40.9 p-90 -65.53 -25.06 67.28 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 119.171 -1.012 . . . . 0.0 112.176 -177.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.683 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 23.3 m-85 -69.14 -53.96 17.4 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 176.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.4 pt20 -57.04 -28.52 62.59 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.9 179.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 N--CA 1.453 -0.302 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.883 178.653 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.511 ' HA ' HD23 ' A' ' 26' ' ' LEU . 0.8 OUTLIER . . . . . 0 CA--C 1.519 -0.218 0 CA-C-O 121.887 0.851 . . . . 0.0 109.632 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.95 -27.91 12.69 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.288 -1.324 . . . . 0.0 110.868 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.513 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.0 p90 -107.45 -44.81 4.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.85 -178.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.513 ' N ' ' CG ' ' A' ' 25' ' ' TYR . 1.1 pp -50.61 -26.21 5.09 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.237 0.541 . . . . 0.0 110.601 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.436 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 1.2 p -65.39 -19.5 65.97 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.331 -0.849 . . . . 0.0 109.768 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -133.73 7.44 3.79 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.248 178.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.428 ' N ' ' O ' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -110.81 -50.37 2.96 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.394 179.99 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -117.74 -9.02 10.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.207 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 26' ' ' LEU . 4.5 ttp85 -54.08 -27.91 35.75 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.968 0.413 . . . . 0.0 110.589 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -82.65 -27.63 31.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.628 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.52 -40.1 43.84 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.921 179.054 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.584 ' O ' ' N ' ' A' ' 37' ' ' GLU . 0.2 OUTLIER -64.25 -59.5 4.33 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.574 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.6 t -38.75 -32.82 0.09 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.353 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.7 m -80.49 -27.1 37.86 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.448 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.584 ' N ' ' O ' ' A' ' 34' ' ' LEU . 8.9 tm-20 -73.74 -61.26 1.9 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.884 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.527 HD23 HD12 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -53.88 -53.25 55.15 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.105 0.478 . . . . 0.0 110.396 179.783 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.55 36.09 1.64 Allowed Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.595 -179.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.527 HD12 HD23 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -117.57 -160.53 0.78 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.144 0.497 . . . . 0.0 111.398 -179.442 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -118.62 -101.32 0.43 Allowed 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.645 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -128.14 -44.22 1.45 Allowed 'General case' 0 C--O 1.231 0.098 0 CA-C-O 120.689 0.281 . . . . 0.0 111.636 -179.237 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.56 -2.79 21.21 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.788 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.5 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 0.8 OUTLIER -106.57 -21.99 12.9 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.347 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.739 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 42.1 mm -58.03 -61.57 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 178.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -57.68 -16.45 10.78 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.667 178.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.424 ' HB ' ' O ' ' A' ' 44' ' ' GLN . 1.3 mp -76.3 -39.96 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -178.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.739 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -74.23 -41.44 61.33 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 118.797 -1.161 . . . . 0.0 111.846 -179.111 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.696 ' CE1' ' CZ3' ' A' ' 48' ' ' TRP . 2.1 m-85 -57.57 -34.3 69.06 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 119.425 -0.91 . . . . 0.0 108.968 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -50.79 -28.22 8.85 Favored 'General case' 0 C--O 1.231 0.081 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.948 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 . . . . . 0 N--CA 1.453 -0.283 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.264 179.149 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.531 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 2.9 m120 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 121.193 0.521 . . . . 0.0 110.231 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.23 -44.55 1.88 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.365 -178.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.449 ' C ' ' H ' ' A' ' 27' ' ' THR . 3.5 p90 -88.19 -34.17 17.9 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.135 -178.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.531 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER -55.26 -8.94 0.36 Allowed 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.233 -179.861 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.454 ' CG2' HD23 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -91.52 11.34 24.4 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.179 179.839 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.72 -42.35 0.07 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.212 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.84 -55.43 4.99 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.452 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.408 ' HD2' ' HB2' ' A' ' 26' ' ' LEU . 0.7 OUTLIER -89.07 -20.63 24.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.725 179.6 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.44 -43.64 93.09 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.645 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -64.69 -29.01 70.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.944 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.456 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.21 -40.02 38.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.777 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.626 ' HB3' ' CH2' ' A' ' 48' ' ' TRP . 10.8 mt -70.37 -59.04 3.1 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.551 ' HA ' HD22 ' A' ' 40' ' ' LEU . 2.2 t -39.51 -33.15 0.15 Allowed 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.38 178.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.82 -38.23 46.8 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.517 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 34' ' ' LEU . 5.4 mt-10 -88.88 -18.8 26.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.51 -179.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.581 ' HG ' ' CE2' ' A' ' 48' ' ' TRP . 4.2 mm? -89.11 -1.06 57.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.63 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 48.93 69.3 1.03 Allowed Glycine 0 C--N 1.335 0.487 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.876 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.62 ' HB2' ' HB2' ' A' ' 44' ' ' GLN . 1.8 pt? -154.22 -150.85 0.34 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.357 0.598 . . . . 0.0 111.676 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -136.1 -89.71 0.3 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.692 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.438 ' HA ' HG13 ' A' ' 45' ' ' ILE . 2.5 tt0 -137.08 -46.9 0.58 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.798 0.332 . . . . 0.0 111.541 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.23 -19.61 66.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.685 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.73 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -95.36 -18.57 20.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.984 0.421 . . . . 0.0 110.105 179.775 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.764 HD12 ' CH2' ' A' ' 48' ' ' TRP . 7.7 mm -54.71 -47.47 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.447 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -68.39 -10.59 56.14 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.789 178.172 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.73 ' HB ' ' O ' ' A' ' 44' ' ' GLN . 1.1 mp -73.57 -32.34 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.381 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.764 ' CH2' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -71.44 -54.45 10.61 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.557 179.513 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.604 ' CZ ' ' CE3' ' A' ' 48' ' ' TRP . 1.5 m-85 -64.09 -39.12 93.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.667 -178.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.464 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 3.6 pt20 -58.95 -24.93 63.07 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.316 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.471 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 121.092 0.472 . . . . 0.0 110.463 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -133.69 -32.72 1.11 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.664 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.518 ' CE1' HD22 ' A' ' 26' ' ' LEU . 16.7 p90 -105.09 -45.38 4.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.255 -0.429 . . . . 0.0 112.151 -178.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.518 HD22 ' CE1' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -46.34 -35.23 5.2 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.656 0.741 . . . . 0.0 109.939 -179.696 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.429 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -51.52 -25.78 7.29 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.11 178.629 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -136.05 24.61 3.3 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.326 179.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.22 -52.03 0.96 Allowed 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.992 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.477 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -133.06 18.24 4.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.342 179.963 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 26' ' ' LEU . 44.0 ttp85 -67.38 -41.67 84.64 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.188 0.518 . . . . 0.0 109.8 179.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -43.0 91.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.226 179.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.53 -32.51 68.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.181 0.515 . . . . 0.0 109.912 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.661 HD21 ' CZ2' ' A' ' 48' ' ' TRP . 5.8 mt -67.39 -57.85 5.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.338 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.4 t -51.25 -25.88 6.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.168 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.0 m -91.46 -20.34 21.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.416 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -114.34 27.77 9.24 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.812 0.339 . . . . 0.0 111.024 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.458 ' HB3' ' CD1' ' A' ' 40' ' ' LEU . 0.8 OUTLIER -134.27 -59.57 0.82 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.122 0.487 . . . . 0.0 110.633 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 128.22 -6.96 6.76 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.754 -179.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.458 ' CD1' ' HB3' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -91.27 -158.66 0.57 Allowed 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.288 0.566 . . . . 0.0 111.065 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -118.93 -71.67 0.73 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.262 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -169.68 -44.31 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.456 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -64.41 -18.58 64.84 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.999 178.447 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.416 ' HB2' ' HB3' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -98.82 -17.71 18.31 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.817 178.916 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.917 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 3.5 mm -62.22 -59.29 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.567 178.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.492 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 6.6 pttt -56.68 -18.74 13.32 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.22 178.382 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.456 ' CD1' ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -79.09 -48.84 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 -178.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.917 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 44.1 p-90 -64.39 -25.38 67.99 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 119.373 -0.931 . . . . 0.0 112.323 -177.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.703 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 27.0 m-85 -66.94 -52.8 38.59 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 177.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -56.23 -27.3 54.44 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.997 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 . . . . . 0 N--CA 1.452 -0.332 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.842 178.834 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.695 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.455 -0.204 0 CA-C-O 121.604 0.716 . . . . 0.0 110.361 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.419 ' HG3' ' N ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -99.5 -43.25 6.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.422 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.52 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 12.4 p90 -79.75 -44.25 21.07 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.656 -1.157 . . . . 0.0 111.79 -179.042 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.695 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.5 OUTLIER -50.05 -27.62 5.86 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.342 0.592 . . . . 0.0 110.319 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.46 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 2.3 p -61.37 -20.24 62.79 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.725 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -136.37 12.35 3.26 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.521 179.05 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.84 -29.97 4.21 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.042 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.423 ' HG3' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -146.64 20.25 1.32 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.784 179.886 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.46 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 2.3 ttt180 -88.57 -44.0 10.97 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 121.044 0.449 . . . . 0.0 109.813 179.35 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -59.75 -28.85 67.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.817 -0.628 . . . . 0.0 109.799 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.514 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -67.73 -34.87 77.69 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.271 179.421 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.701 ' HB3' ' CH2' ' A' ' 48' ' ' TRP . 0.9 OUTLIER -71.97 -61.41 1.8 Allowed 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.431 179.295 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.414 ' HB2' HD12 ' A' ' 45' ' ' ILE . 10.7 t -44.72 -29.5 0.78 Allowed 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.878 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.52 -26.43 18.78 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.179 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 34' ' ' LEU . 4.3 tt0 -106.04 20.11 19.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.786 0.327 . . . . 0.0 110.88 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.447 ' CB ' ' CD1' ' A' ' 40' ' ' LEU . 2.7 mm? -118.72 -43.43 2.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.39 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 99.31 34.87 4.92 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.669 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.494 HD22 ' CD1' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -123.93 -159.6 0.87 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.23 0.538 . . . . 0.0 111.646 -179.378 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.51 -84.82 0.65 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.794 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -147.07 -46.9 0.18 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.859 0.361 . . . . 0.0 110.681 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.446 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -67.6 -11.68 58.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.265 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.48 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -97.65 -19.89 17.98 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.004 0.43 . . . . 0.0 109.969 179.222 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.613 ' HA ' ' CE2' ' A' ' 48' ' ' TRP . 44.8 mm -56.69 -61.39 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.668 178.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -59.58 -14.76 14.59 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.822 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.49 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 1.3 mp -77.73 -37.58 24.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -178.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.789 ' CZ3' ' CZ ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -76.52 -33.41 58.6 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 118.505 -1.278 . . . . 0.0 111.975 -179.154 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.789 ' CZ ' ' CZ3' ' A' ' 48' ' ' TRP . 5.4 m-85 -66.94 -42.68 84.88 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 119.675 -0.81 . . . . 0.0 109.09 178.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.49 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 6.3 pt20 -62.84 -31.27 72.25 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 . . . . . 0 N--CA 1.452 -0.326 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.642 178.666 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.403 ' N ' HD22 ' A' ' 26' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.462 0.134 0 CA-C-O 121.145 0.497 . . . . 0.0 110.762 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.14 -38.34 1.23 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.12 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.528 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 19.6 p90 -94.27 -44.98 7.7 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.596 -178.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.571 ' O ' ' N ' ' A' ' 31' ' ' ARG . 0.3 OUTLIER -49.29 -29.64 6.25 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.358 0.599 . . . . 0.0 110.102 -179.564 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.2 p -57.79 -22.04 45.06 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.114 178.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -133.42 10.18 4.06 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.611 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -123.79 -40.65 2.3 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-O 120.969 0.414 . . . . 0.0 110.921 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.57 -12.51 10.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.085 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.571 ' N ' ' O ' ' A' ' 26' ' ' LEU . 3.6 ttt180 -56.96 -23.74 47.91 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.848 0.356 . . . . 0.0 110.81 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.01 -19.37 40.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.281 179.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.51 -46.24 11.04 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.27 179.488 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.559 ' O ' ' N ' ' A' ' 37' ' ' GLU . 0.2 OUTLIER -63.51 -59.14 5.03 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.914 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.5 t -39.38 -32.76 0.13 Allowed 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.356 179.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.5 -27.82 41.44 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.194 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 34' ' ' LEU . 0.6 OUTLIER -73.39 -60.84 2.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.889 179.899 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.575 HD21 HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -56.29 -53.44 57.21 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.099 0.476 . . . . 0.0 110.41 179.846 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 114.12 43.15 0.8 Allowed Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.723 -179.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.575 HD11 HD21 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -129.63 -160.93 1.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.992 0.425 . . . . 0.0 111.398 -179.383 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.43 ' OD1' ' N ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -119.46 -91.58 0.55 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.16 -179.299 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.403 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 1.2 mp0 -136.77 -45.7 0.59 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.765 0.317 . . . . 0.0 111.333 -179.165 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.43 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -66.36 -11.76 52.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.265 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.492 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 0.4 OUTLIER -103.39 -21.33 13.82 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.464 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.756 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 42.5 mm -57.41 -61.14 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.492 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.453 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 9.4 ttmt -57.56 -17.0 11.73 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.757 178.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.43 ' CD1' ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -77.3 -34.83 21.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 -178.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.756 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -79.83 -32.4 40.62 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 118.685 -1.206 . . . . 0.0 111.611 -179.488 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.721 ' CE1' ' CZ3' ' A' ' 48' ' ' TRP . 3.7 m-85 -65.71 -41.49 92.24 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 119.655 -0.818 . . . . 0.0 109.179 178.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.425 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 5.1 pt20 -61.36 -26.33 67.75 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 121.075 0.464 . . . . 0.0 109.805 179.25 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.924 178.939 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.54 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 121.248 0.547 . . . . 0.0 109.803 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.45 -38.12 2.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.745 -178.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.455 ' C ' ' H ' ' A' ' 27' ' ' THR . 8.8 p90 -92.68 -36.99 12.64 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.397 -178.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.54 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -53.94 -9.98 0.29 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.331 -179.944 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.501 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.5 OUTLIER -83.16 -22.69 33.2 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.649 179.617 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -133.09 16.04 4.18 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.069 178.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.0 tpt180 -121.26 -55.97 1.93 Allowed 'General case' 0 C--O 1.231 0.099 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.503 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.415 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -120.07 4.1 10.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.135 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.501 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.3 OUTLIER -56.86 -28.37 61.65 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 121.009 0.433 . . . . 0.0 110.318 179.454 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -79.13 -20.41 48.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.171 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.23 -44.99 11.04 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.663 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.573 HD23 ' CZ2' ' A' ' 48' ' ' TRP . 0.6 OUTLIER -57.77 -45.82 85.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.787 179.107 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.8 t -48.01 -26.64 1.86 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.093 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.47 -10.58 21.99 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.509 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -76.3 -61.83 1.82 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.745 0.307 . . . . 0.0 111.062 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.558 HD21 ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -71.36 -47.27 57.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.117 0.484 . . . . 0.0 110.239 179.66 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 123.35 4.47 8.3 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.465 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.454 HD21 ' CD1' ' A' ' 48' ' ' TRP . 0.3 OUTLIER -106.71 -167.99 1.36 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.955 0.407 . . . . 0.0 111.208 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.586 ' O ' HG12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -113.8 171.62 7.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.894 -179.888 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.446 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 49.5 mt-10 -52.78 -39.0 61.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.575 -179.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.72 -23.5 42.86 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.316 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.541 ' HA ' ' HB ' ' A' ' 47' ' ' ILE . 0.8 OUTLIER -107.66 -21.77 12.75 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.666 179.687 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.92 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 10.8 mm -57.32 -57.79 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.28 179.148 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.432 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -59.84 -20.05 54.65 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.151 178.093 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.541 ' HB ' ' HA ' ' A' ' 44' ' ' GLN . 1.4 mp -79.2 -46.73 23.22 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -178.375 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.92 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 25.2 p-90 -66.54 -30.17 70.42 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 119.003 -1.079 . . . . 0.0 111.958 -177.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.649 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 21.5 m-85 -64.17 -53.52 48.09 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 177.083 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 10.4 pt20 -56.72 -25.65 55.0 Favored 'General case' 0 N--CA 1.457 -0.087 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.109 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.2 m-20 . . . . . 0 N--CA 1.454 -0.272 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.216 179.135 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.476 ' CG ' ' O ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER . . . . . 0 CA--C 1.539 0.542 0 CA-C-O 120.98 0.419 . . . . 0.0 111.039 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.472 ' O ' ' CG2' ' A' ' 27' ' ' THR . 0.0 OUTLIER -138.22 -59.29 0.64 Allowed 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.354 0.597 . . . . 0.0 110.575 179.792 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.501 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 1.6 p90 -45.6 -29.87 1.33 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.013 179.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.501 ' N ' ' CD1' ' A' ' 25' ' ' TYR . 2.6 pt? -57.26 -10.8 1.41 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.76 -178.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.529 ' HA ' ' HB3' ' A' ' 31' ' ' ARG . 1.3 p -93.51 -5.77 48.32 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.301 0.572 . . . . 0.0 109.63 179.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -148.51 22.35 1.03 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.015 179.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.406 ' N ' ' O ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -151.59 -39.09 0.12 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.214 -179.524 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.41 ' CG ' ' O ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -128.9 32.2 4.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.024 179.645 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.529 ' HB3' ' HA ' ' A' ' 27' ' ' THR . 0.0 OUTLIER -96.58 -25.38 15.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.759 -179.7 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -99.62 -8.22 24.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.131 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.99 -38.68 8.49 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 178.663 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.543 HD21 ' CZ2' ' A' ' 48' ' ' TRP . 3.6 tt -68.01 -52.72 32.42 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.271 -1.331 . . . . 0.0 109.254 178.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.507 ' HA ' HD11 ' A' ' 45' ' ' ILE . 10.7 t -58.75 -20.71 51.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.443 179.066 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 75.2 m -91.1 -16.84 27.16 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.453 ' HG3' ' HG ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -100.82 23.56 10.42 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.381 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.589 ' HB2' HD13 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -166.94 16.39 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.617 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 45.59 32.89 4.33 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.025 -0.607 . . . . 0.0 113.351 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.589 HD13 ' HB2' ' A' ' 38' ' ' LEU . 11.6 mt -99.87 142.94 30.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.86 0.362 . . . . 0.0 110.43 179.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.475 ' O ' HG12 ' A' ' 45' ' ' ILE . 0.7 OUTLIER -68.41 141.14 55.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.247 -179.541 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.99 -33.76 18.89 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 121.184 0.516 . . . . 0.0 110.428 179.789 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.46 -33.01 37.03 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.778 0.799 . . . . 0.0 109.739 178.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.422 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -77.44 -16.38 58.82 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.457 -179.635 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.553 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 16.7 mm -62.43 -49.28 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.003 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 22.3 mtmt -70.86 -4.39 24.05 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.946 178.209 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.479 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 1.5 mp -86.45 -32.92 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -178.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.553 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -78.81 -44.99 21.89 Favored 'General case' 0 N--CA 1.461 0.078 0 C-N-CA 118.113 -1.435 . . . . 0.0 111.141 179.689 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.548 ' CE1' ' CZ3' ' A' ' 48' ' ' TRP . 6.0 m-85 -55.52 -43.86 76.13 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 120.104 -0.638 . . . . 0.0 109.625 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.479 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 4.6 pt20 -61.47 -24.77 66.8 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.177 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.355 179.294 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.425 ' O ' ' HG2' ' A' ' 24' ' ' ARG . 0.6 OUTLIER . . . . . 0 N--CA 1.461 0.124 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.427 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -146.92 -46.01 0.18 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.761 0.791 . . . . 0.0 109.925 179.521 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.487 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 4.2 p90 -54.78 -38.2 66.97 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.596 -1.184 . . . . 0.0 110.337 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.487 ' N ' ' CG ' ' A' ' 25' ' ' TYR . 1.9 pt? -53.15 -26.77 18.16 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.696 -179.301 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.428 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 6.6 p -67.01 -17.68 65.03 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.418 178.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -135.75 19.07 3.28 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.783 178.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.46 -46.71 1.75 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.664 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.8 11.33 3.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.499 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.475 ' N ' ' O ' ' A' ' 26' ' ' LEU . 1.4 ttm180 -64.66 -34.65 78.79 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.124 0.488 . . . . 0.0 110.111 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -76.91 -10.2 59.21 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.962 179.052 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.85 -15.24 16.28 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.817 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.599 ' O ' HD12 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -102.0 -3.1 28.26 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.47 179.513 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.509 ' HA ' HD11 ' A' ' 45' ' ' ILE . 3.1 t -112.79 -3.18 14.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.637 179.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -116.27 -23.21 8.49 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.237 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.517 ' C ' HD11 ' A' ' 38' ' ' LEU . 0.7 OUTLIER -91.3 15.52 11.86 Favored 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 111.736 0.272 . . . . 0.0 111.736 -179.72 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.599 HD12 ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -158.89 23.11 0.21 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.721 0.296 . . . . 0.0 111.224 -179.08 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 53.2 22.61 14.63 Favored Glycine 0 CA--C 1.518 0.254 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.941 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.543 HD13 ' HB2' ' A' ' 38' ' ' LEU . 6.4 mt -89.75 -171.39 3.16 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.008 0.432 . . . . 0.0 110.828 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.521 ' O ' HG12 ' A' ' 45' ' ' ILE . 1.7 t30 -133.47 140.29 47.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.418 178.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -46.97 -27.97 1.47 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.086 0.47 . . . . 0.0 110.948 -179.553 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.85 -40.42 32.71 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.461 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.49 ' HA ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -84.64 -11.8 55.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.353 -179.473 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.698 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 20.4 mm -55.77 -52.96 42.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.53 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 38.4 mtmt -63.3 -16.26 59.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.248 177.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.49 ' HB ' ' HA ' ' A' ' 44' ' ' GLN . 1.3 mp -79.94 -44.4 22.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -178.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.698 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 13.3 p-90 -71.36 -27.38 63.31 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 118.645 -1.222 . . . . 0.0 111.95 -178.284 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.668 ' CE1' ' CZ3' ' A' ' 48' ' ' TRP . 23.0 m-85 -66.25 -51.07 61.16 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 177.01 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.3 pt20 -58.05 -25.84 61.72 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.021 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 . . . . . 0 N--CA 1.453 -0.29 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.017 179.013 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.576 ' HA ' HD21 ' A' ' 26' ' ' LEU . 9.6 m120 . . . . . 0 N--CA 1.465 0.293 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.1 ttm180 -138.29 -34.02 0.66 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 -177.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.591 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 13.3 p90 -110.47 -50.25 2.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.724 0.297 . . . . 0.0 111.368 -178.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.591 ' N ' ' CG ' ' A' ' 25' ' ' TYR . 1.4 pt? -45.64 -34.61 3.55 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.364 0.602 . . . . 0.0 110.005 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.401 ' HB ' ' NH1' ' A' ' 31' ' ' ARG . 1.1 p -52.07 -25.69 9.27 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.884 178.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -132.1 27.94 4.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.878 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.99 -46.28 0.35 Allowed 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.016 -179.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.511 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -113.14 -18.27 12.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.011 -179.627 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.401 ' NH1' ' HB ' ' A' ' 27' ' ' THR . 5.6 ttm180 -50.46 -30.97 13.91 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.049 0.452 . . . . 0.0 110.553 179.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -72.95 -35.12 66.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.192 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.479 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.5 OUTLIER -74.29 -37.63 63.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.021 179.34 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.687 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 5.8 mt -64.22 -50.09 69.39 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.928 179.267 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.7 t -45.69 -28.7 1.06 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.263 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -97.22 -14.1 21.62 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.74 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.426 ' N ' ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -84.66 -66.56 0.88 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.6 0.238 . . . . 0.0 111.258 -179.713 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.444 ' CD2' ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -60.25 -50.12 74.93 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.033 0.444 . . . . 0.0 110.65 -179.919 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 127.5 -1.93 7.04 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.359 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.427 ' CD1' ' CD2' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -96.48 -161.75 0.9 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.913 0.387 . . . . 0.0 110.944 179.867 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -112.26 -100.75 0.41 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.519 -179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -133.21 -47.45 0.84 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.779 0.323 . . . . 0.0 110.916 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.446 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -60.97 -14.79 25.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.894 179.336 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.522 ' H ' ' NE2' ' A' ' 44' ' ' GLN . 0.8 OUTLIER -102.32 -20.65 14.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.266 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.873 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 8.4 mm -60.42 -59.61 3.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.635 178.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.446 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 15.9 mtmt -58.11 -17.82 20.91 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.26 178.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.495 ' O ' ' HG2' ' A' ' 50' ' ' GLN . 1.4 mp -80.26 -43.21 21.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -178.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.873 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 32.4 p-90 -70.72 -26.95 63.63 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 118.904 -1.119 . . . . 0.0 112.197 -177.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.674 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 10.8 m-85 -67.97 -49.33 62.34 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.184 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.495 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.9 pt20 -59.35 -25.67 64.42 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.996 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 . . . . . 0 N--CA 1.454 -0.259 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.946 178.869 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.531 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 1.1 m-80 . . . . . 0 C--O 1.232 0.136 0 CA-C-O 121.106 0.479 . . . . 0.0 109.986 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.95 -33.44 3.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.209 -178.019 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.483 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.2 p90 -100.24 -38.67 8.4 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.524 -178.084 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.531 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.5 OUTLIER -54.1 -9.77 0.29 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.346 -179.77 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.524 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 1.0 OUTLIER -84.8 -16.71 40.54 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.871 179.77 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -138.8 15.07 2.69 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.315 179.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.13 -48.14 2.12 Favored 'General case' 0 CA--C 1.522 -0.103 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.379 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -126.36 2.7 7.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.13 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.524 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.0 OUTLIER -60.41 -21.25 62.01 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 120.98 0.419 . . . . 0.0 110.741 179.391 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -88.34 -32.92 18.17 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 179.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.28 -36.31 79.18 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.851 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.674 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 12.7 mt -67.12 -60.64 2.45 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.837 179.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.2 t -50.48 -24.85 3.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.392 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 98.9 p -92.66 -33.78 14.23 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.676 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.41 24.39 9.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.707 0.289 . . . . 0.0 111.601 -179.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.46 ' CD2' ' CD2' ' A' ' 34' ' ' LEU . 1.8 mm? -128.1 -53.87 1.29 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.265 0.555 . . . . 0.0 110.507 179.599 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.71 -3.46 13.37 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.586 -178.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.45 ' CD1' ' HB3' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -94.92 -160.09 0.76 Allowed 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.399 0.618 . . . . 0.0 111.228 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -117.55 -80.79 0.61 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.902 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -160.04 -43.49 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.444 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -67.53 -12.74 61.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.382 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.537 ' H ' ' NE2' ' A' ' 44' ' ' GLN . 1.3 mp0 -102.19 -18.45 15.51 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.926 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 4.0 mm -62.21 -60.07 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.316 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.524 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -55.52 -19.69 10.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.22 178.332 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.444 ' CD1' ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -77.85 -47.12 25.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -178.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.926 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 46.6 p-90 -67.67 -28.9 68.09 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 119.577 -0.849 . . . . 0.0 112.412 -177.361 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.719 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 17.5 m-85 -62.08 -43.79 98.07 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 177.348 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.407 ' HB2' ' O ' ' A' ' 47' ' ' ILE . 30.0 mt-30 -50.55 -34.08 24.2 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.04 179.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 . . . . . 0 N--CA 1.447 -0.614 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.071 179.581 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.439 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 121.11 0.481 . . . . 0.0 110.659 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.12 -45.78 4.82 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.518 0.675 . . . . 0.0 110.897 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.509 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.8 p90 -76.18 -42.68 45.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.861 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.551 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . 1.3 pt? -52.98 -22.12 5.26 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.101 0.477 . . . . 0.0 110.707 -179.063 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.571 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 2.7 p -64.72 -21.35 66.73 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.551 178.584 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -130.8 11.55 5.19 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.859 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -110.61 -47.57 3.24 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.729 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.551 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -144.62 14.7 1.58 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.741 179.695 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.571 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.1 OUTLIER -75.04 -35.69 61.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.016 0.436 . . . . 0.0 109.924 179.352 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.1 mp0 -61.39 -25.64 67.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.952 179.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.536 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -61.37 -37.33 83.0 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.072 179.446 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.651 ' CB ' ' CZ3' ' A' ' 48' ' ' TRP . 1.0 OUTLIER -73.52 -61.99 1.64 Allowed 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.226 178.705 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.415 ' HB2' HD12 ' A' ' 45' ' ' ILE . 19.7 t -45.65 -27.28 0.76 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.956 178.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.3 t -96.35 -17.47 20.63 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.765 -179.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 34' ' ' LEU . 22.8 mt-10 -121.52 20.52 11.12 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.753 0.311 . . . . 0.0 111.024 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.536 ' HB3' ' CD1' ' A' ' 40' ' ' LEU . 1.6 mm? -110.12 -55.56 2.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.25 0.548 . . . . 0.0 110.364 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 108.77 35.6 2.37 Favored Glycine 0 N--CA 1.448 -0.536 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.125 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.536 ' CD1' ' HB3' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -122.2 -157.11 0.72 Allowed 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.192 0.52 . . . . 0.0 111.143 -179.165 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -126.11 -106.45 0.33 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.737 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -125.78 -40.1 2.08 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.66 1.89 18.43 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.522 ' NE2' ' N ' ' A' ' 44' ' ' GLN . 1.0 OUTLIER -108.42 -21.07 12.9 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.444 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.679 ' HA ' ' CE2' ' A' ' 48' ' ' TRP . 32.7 mm -57.39 -59.05 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.907 0 CA-C-O 121.271 0.558 . . . . 0.0 109.711 178.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt -61.09 -16.33 42.79 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.451 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.492 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 1.3 mp -73.8 -38.68 51.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -178.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.733 ' CZ3' ' CZ ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -69.51 -47.86 62.43 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 118.92 -1.112 . . . . 0.0 111.235 -179.501 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.733 ' CZ ' ' CZ3' ' A' ' 48' ' ' TRP . 2.1 m-85 -63.32 -41.41 98.91 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 121.037 -0.265 . . . . 0.0 111.042 -179.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.492 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 5.0 pt20 -64.04 -26.17 68.44 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.177 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.345 179.155 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.158 0 CA-C-O 121.024 0.44 . . . . 0.0 110.741 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.76 -36.34 2.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.198 -179.549 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.595 ' CE1' HD23 ' A' ' 26' ' ' LEU . 25.2 p90 -96.93 -46.41 6.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.748 -178.635 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.595 HD23 ' CE1' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -48.58 -31.27 6.33 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.516 0.674 . . . . 0.0 109.641 179.84 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.532 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 1.4 p -53.65 -24.7 15.08 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.951 178.496 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -133.65 17.69 3.93 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.997 178.769 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.403 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -120.33 -50.0 2.25 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.697 -179.869 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.42 6.59 3.82 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.577 179.99 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.532 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 47.4 ttt180 -75.62 -7.34 54.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.701 0.286 . . . . 0.0 111.182 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -94.66 -23.33 17.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.356 0.598 . . . . 0.0 109.484 178.901 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.82 -42.77 21.09 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.888 179.037 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.503 HD22 ' CH2' ' A' ' 48' ' ' TRP . 0.3 OUTLIER -63.51 -58.91 5.49 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.045 179.064 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.463 ' HA ' HD12 ' A' ' 40' ' ' LEU . 32.8 t -41.74 -32.32 0.38 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.272 179.331 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.5 m -89.71 -33.06 16.74 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.846 179.83 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.403 ' N ' ' O ' ' A' ' 34' ' ' LEU . 36.0 tt0 -67.32 -14.75 63.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.467 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.576 HD11 HD13 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -112.04 -44.93 3.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.776 0.322 . . . . 0.0 110.722 -179.763 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 109.73 46.07 0.93 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.912 179.475 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.576 HD13 HD11 ' A' ' 38' ' ' LEU . 0.4 OUTLIER -144.85 -168.51 2.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.755 0.312 . . . . 0.0 111.011 179.689 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.688 ' O ' HG12 ' A' ' 45' ' ' ILE . 4.9 p30 -129.7 -175.15 3.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.86 -179.722 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.484 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 9.0 mt-10 -49.23 -34.69 15.56 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -177.939 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.19 -23.18 67.31 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -178.814 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.541 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -112.03 -19.13 12.44 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 121.034 -0.266 . . . . 0.0 110.796 -179.272 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.688 HG12 ' O ' ' A' ' 41' ' ' ASN . 38.8 mm -52.12 -60.73 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.845 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 34.6 pttt -59.21 -19.9 49.41 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.661 178.856 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.538 ' HB ' ' HA ' ' A' ' 44' ' ' GLN . 1.7 mp -78.63 -40.78 24.32 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -178.409 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.756 ' CZ3' ' CE1' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -72.84 -31.94 65.11 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 118.513 -1.275 . . . . 0.0 112.296 -178.227 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.756 ' CE1' ' CZ3' ' A' ' 48' ' ' TRP . 9.1 m-85 -66.4 -44.66 82.4 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 119.608 -0.837 . . . . 0.0 109.374 178.474 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.472 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 1.5 pt20 -58.63 -27.23 64.51 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.207 179.751 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.2 179.138 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.534 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.92 0.39 . . . . 0.0 110.562 . . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -126.79 -35.45 2.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.32 -178.078 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.443 ' C ' ' H ' ' A' ' 27' ' ' THR . 4.7 p90 -101.89 -34.94 9.19 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.379 -178.211 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.534 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -55.11 -10.12 0.49 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.068 179.725 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.459 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -86.73 -16.87 35.11 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.931 179.92 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -140.08 17.74 2.45 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.193 179.218 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -127.41 -53.15 1.37 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.826 -179.559 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.405 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.8 OUTLIER -121.76 3.98 10.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.449 -179.947 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.59 -38.69 69.74 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.069 0.461 . . . . 0.0 110.304 179.669 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -71.88 -46.42 57.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.246 179.253 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.48 -32.85 65.39 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.266 0.555 . . . . 0.0 109.932 179.087 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.627 HD21 ' CZ2' ' A' ' 48' ' ' TRP . 5.0 mt -67.51 -55.95 11.49 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.686 179.845 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.8 t -59.34 -21.12 59.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.035 -179.76 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.0 t -95.26 -14.16 24.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.569 -179.643 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -106.12 -29.05 10.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.01 0.433 . . . . 0.0 110.507 179.843 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.46 ' HB3' ' CD1' ' A' ' 40' ' ' LEU . 4.0 mm? -78.89 -58.55 3.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.749 179.778 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 109.81 15.98 11.34 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.813 -179.114 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.506 HD23 ' NE2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -107.98 -162.64 0.84 Allowed 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.144 0.497 . . . . 0.0 111.361 -179.851 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.428 ' O ' ' N ' ' A' ' 45' ' ' ILE . 0.7 OUTLIER -97.3 146.79 24.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.337 -179.783 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -52.19 -36.7 52.65 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 121.218 0.532 . . . . 0.0 109.904 179.573 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.77 -33.97 60.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.104 178.239 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.541 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -75.82 -13.79 60.29 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.828 179.715 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.868 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 3.0 mm -65.53 -56.91 13.0 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.494 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.51 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.551 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 30.4 mtmt -54.45 -18.82 4.67 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.962 177.71 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.541 ' HB ' ' O ' ' A' ' 44' ' ' GLN . 1.2 mp -76.1 -46.19 34.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -178.851 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.868 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 34.4 p-90 -68.19 -28.21 67.06 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 119.553 -0.859 . . . . 0.0 112.651 -177.453 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.696 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 12.1 m-85 -63.61 -42.54 98.21 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.542 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -56.78 -33.54 66.76 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.679 179.147 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 . . . . . 0 N--CA 1.452 -0.357 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.126 179.204 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.533 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 121.273 0.559 . . . . 0.0 109.633 . . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.85 -42.12 2.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.146 -0.933 . . . . 0.0 111.453 -178.545 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.459 ' C ' ' H ' ' A' ' 27' ' ' THR . 6.9 p90 -88.92 -35.77 16.29 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.279 -178.692 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.533 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER -54.26 -9.02 0.24 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.15 0.5 . . . . 0.0 111.371 -179.891 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.459 ' H ' ' C ' ' A' ' 25' ' ' TYR . 0.5 OUTLIER -88.01 -19.51 27.07 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.927 179.941 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -132.57 12.4 4.48 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.975 178.591 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.22 -44.44 1.14 Allowed 'General case' 0 C--O 1.231 0.098 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.111 179.981 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.433 ' HD3' ' CB ' ' A' ' 26' ' ' LEU . 14.9 mtp180 -110.97 -3.56 15.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.896 179.548 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -11.09 39.38 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.737 0.303 . . . . 0.0 111.066 179.773 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -95.91 -19.78 19.27 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.718 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -86.93 -47.89 8.61 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.994 179.234 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.546 ' HB3' ' CZ3' ' A' ' 48' ' ' TRP . 0.5 OUTLIER -61.66 -48.35 81.22 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.87 179.764 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.511 ' HA ' HD13 ' A' ' 40' ' ' LEU . 6.1 t -50.49 -37.23 37.61 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.892 179.213 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.5 t -98.6 7.7 45.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.472 179.131 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.507 ' C ' HD11 ' A' ' 38' ' ' LEU . 11.5 tt0 -92.88 -38.48 11.7 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.583 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.727 ' CD1' ' N ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -107.82 19.57 19.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.353 -179.406 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 56.25 63.67 5.1 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.478 -0.867 . . . . 0.0 111.455 -179.185 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.511 HD13 ' HA ' ' A' ' 35' ' ' SER . 0.0 OUTLIER -137.93 -160.33 1.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.203 0.525 . . . . 0.0 111.952 -178.428 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.7 -83.89 0.17 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.001 179.97 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.404 ' HA ' HG12 ' A' ' 45' ' ' ILE . 6.0 mp0 -141.45 -39.54 0.39 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.898 0.38 . . . . 0.0 110.633 -179.588 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.434 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -66.44 -12.96 59.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.691 -179.953 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.513 ' O ' ' NE1' ' A' ' 48' ' ' TRP . 1.3 mp0 -111.88 -26.26 9.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.804 0.335 . . . . 0.0 110.53 -179.914 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.679 ' HA ' ' CZ2' ' A' ' 48' ' ' TRP . 8.9 mm -60.52 -64.06 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.747 0 CA-C-O 121.352 0.596 . . . . 0.0 110.24 179.574 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -55.72 -21.85 20.76 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.322 179.576 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.474 ' HB ' ' O ' ' A' ' 44' ' ' GLN . 1.2 mp -64.35 -35.96 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.229 -179.642 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.679 ' CZ2' ' HA ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -71.69 -58.61 3.33 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.485 179.686 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.587 ' CZ ' ' CE3' ' A' ' 48' ' ' TRP . 0.4 OUTLIER -60.26 -25.48 65.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.703 -179.563 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -57.08 -29.95 63.91 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.066 0.46 . . . . 0.0 110.03 179.22 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.326 179.326 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.082 0 CA-C-O 121.214 0.531 . . . . 0.0 111.082 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 24.0 mtm105 -100.26 -49.28 4.32 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.754 0.787 . . . . 0.0 110.412 179.853 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.518 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 4.7 p90 -47.75 -39.81 18.9 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.412 -1.267 . . . . 0.0 111.178 -179.876 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.518 ' N ' ' CG ' ' A' ' 25' ' ' TYR . 3.8 pp -51.19 -30.49 17.24 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.862 -179.074 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.58 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 16.5 p -63.13 -19.27 64.3 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.3 -0.863 . . . . 0.0 109.832 179.163 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -131.94 8.05 4.41 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.481 178.748 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -113.27 -43.69 3.33 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.826 179.937 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.435 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -128.32 -1.36 5.67 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.616 179.853 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.58 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.0 OUTLIER -72.9 -11.16 60.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.786 0.327 . . . . 0.0 110.981 179.702 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -102.66 -21.23 14.15 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.004 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -81.97 -41.14 21.2 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.112 179.294 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.622 ' CB ' ' CZ3' ' A' ' 48' ' ' TRP . 10.4 mt -67.79 -59.67 3.13 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.46 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.586 ' HA ' HD23 ' A' ' 40' ' ' LEU . 4.7 t -38.53 -32.94 0.09 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.675 178.756 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.8 t -81.06 -38.32 27.57 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.926 -179.334 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -86.95 -27.24 23.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.814 0.34 . . . . 0.0 111.473 -179.494 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.586 ' HG ' ' CE2' ' A' ' 48' ' ' TRP . 3.5 mm? -78.32 -2.93 40.45 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.643 -179.667 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 50.64 68.63 1.38 Allowed Glycine 0 C--N 1.334 0.469 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.608 179.884 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.637 ' CD1' ' N ' ' A' ' 45' ' ' ILE . 1.9 pt? -153.21 -151.88 0.39 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.285 0.564 . . . . 0.0 111.694 -179.188 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -136.78 -84.12 0.35 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.804 -179.629 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.44 ' HA ' HG13 ' A' ' 45' ' ' ILE . 11.5 tt0 -141.01 -46.77 0.4 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.854 0.359 . . . . 0.0 111.487 -179.297 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.91 -17.43 64.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.716 -179.659 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.728 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -98.56 -18.14 18.31 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.271 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.762 HD11 ' CH2' ' A' ' 48' ' ' TRP . 6.8 mm -55.35 -46.61 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 178.154 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.36 -10.76 59.36 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.869 -1.059 . . . . 0.0 109.755 178.099 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.728 ' HB ' ' O ' ' A' ' 44' ' ' GLN . 1.2 mp -73.08 -33.2 41.85 Favored 'Isoleucine or valine' 0 C--N 1.342 0.277 0 C-N-CA 121.016 -0.274 . . . . 0.0 111.234 -179.926 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.762 ' CH2' HD11 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -70.87 -60.5 2.2 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.322 179.606 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.582 ' CZ ' ' CE3' ' A' ' 48' ' ' TRP . 1.0 OUTLIER -58.84 -30.07 67.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.509 -179.735 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -51.0 -26.85 6.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.103 0.478 . . . . 0.0 109.938 178.961 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.201 179.106 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.462 0.135 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.423 ' N ' ' CD2' ' A' ' 26' ' ' LEU . 8.0 mmt180 -148.2 -46.22 0.16 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.774 0.797 . . . . 0.0 109.976 179.556 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.51 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 6.1 p90 -58.02 -39.05 77.39 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.546 -1.206 . . . . 0.0 110.248 179.811 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.56 ' HA ' ' HB3' ' A' ' 29' ' ' ARG . 2.1 pt? -52.67 -30.12 30.22 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.342 -179.564 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.524 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 3.7 p -64.28 -18.33 64.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.661 178.918 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -137.04 19.91 3.0 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.078 178.829 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.56 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.7 OUTLIER -126.1 -41.57 1.92 Allowed 'General case' 0 C--O 1.231 0.11 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.089 -179.454 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.7 19.98 0.91 Allowed 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.766 0.284 . . . . 0.0 111.766 -179.781 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.524 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.6 OUTLIER -81.47 -26.11 35.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.858 0.361 . . . . 0.0 110.474 179.687 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -86.46 -21.65 26.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.173 179.145 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.5 -45.14 12.93 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.082 179.344 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.58 HD21 HD23 ' A' ' 38' ' ' LEU . 0.2 OUTLIER -62.88 -57.65 10.08 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.814 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.9 t -40.53 -32.98 0.23 Allowed 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.186 179.718 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.36 -30.08 47.79 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.856 179.727 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.564 ' N ' ' O ' ' A' ' 34' ' ' LEU . 31.5 mt-10 -71.28 -57.13 4.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.811 179.812 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.601 HD21 HD13 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.39 -47.43 85.47 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.125 0.488 . . . . 0.0 110.34 179.7 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.31 30.9 5.48 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.333 -178.837 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.601 HD13 HD21 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -126.61 -168.29 1.84 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.019 0.437 . . . . 0.0 111.343 -179.48 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.585 ' O ' HG12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -124.09 176.83 6.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.064 179.878 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.417 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 13.6 mp0 -46.85 -30.93 2.74 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.006 -178.675 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.63 -19.85 65.2 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.115 -179.481 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.626 ' NE2' ' N ' ' A' ' 44' ' ' GLN . 0.5 OUTLIER -118.72 -20.9 8.09 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.557 -179.023 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.799 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 46.9 mm -50.81 -58.08 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.473 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.415 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 1.5 mtmt -60.34 -25.08 65.55 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.481 178.391 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.556 ' HB ' ' HA ' ' A' ' 44' ' ' GLN . 1.6 mp -70.93 -39.31 75.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -178.585 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.799 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -74.45 -40.6 61.81 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 118.401 -1.32 . . . . 0.0 111.907 -178.859 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.764 ' CE1' ' CZ3' ' A' ' 48' ' ' TRP . 2.8 m-85 -59.92 -33.74 72.27 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.347 -0.941 . . . . 0.0 108.663 178.025 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.4 ' NE2' ' O ' ' A' ' 46' ' ' LYS . 0.9 OUTLIER -49.32 -27.81 4.26 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.909 179.163 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.218 179.319 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.163 0 N-CA-C 112.524 -0.231 . . . . 0.0 112.524 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.7 -174.96 5.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.78 0.324 . . . . 0.0 110.909 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -136.8 46.63 2.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.815 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 15.5 tttp -177.09 66.18 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.819 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.7 mmp_? -114.64 149.28 42.03 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.946 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.37 -165.62 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.575 2.183 . . . . 0.0 112.235 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.09 48.96 1.77 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.529 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.7 -77.9 0.43 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.949 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -67.76 -27.56 66.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.802 0.334 . . . . 0.0 110.782 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.482 ' CD1' ' N ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER 172.29 112.99 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.091 0.472 . . . . 0.0 111.06 179.606 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.502 ' O ' ' CB ' ' A' ' 10' ' ' SER . 0.0 OUTLIER -90.84 36.76 0.91 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.009 -179.563 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.502 ' CB ' ' O ' ' A' ' 9' ' ' SER . 5.5 t 90.35 -30.58 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.517 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -35.33 80.18 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.582 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.444 ' CB ' ' HB3' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -82.29 -31.07 30.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.797 178.885 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.458 ' CD2' ' CD2' ' A' ' 8' ' ' PHE . 11.7 mt -70.27 -34.23 72.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.972 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.62 -31.4 66.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.769 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -66.46 -35.37 80.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.776 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.64 68.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.83 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.666 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.2 OUTLIER -74.4 -59.1 2.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.19 179.491 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -29.36 60.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.084 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -63.03 -48.88 76.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.554 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.666 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.8 p90 -83.96 -25.55 29.97 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.657 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -53.73 -26.58 23.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.098 0.475 . . . . 0.0 109.881 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.462 ' O ' HD22 ' A' ' 26' ' ' LEU . 5.9 mt-10 -97.41 18.55 15.02 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.794 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.559 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.7 OUTLIER -161.22 33.97 0.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.167 179.236 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.2 tpp180 -126.17 -35.59 2.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.228 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.584 ' CE1' HD21 ' A' ' 26' ' ' LEU . 20.5 p90 -100.58 -46.18 5.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.702 -178.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.584 HD21 ' CE1' ' A' ' 25' ' ' TYR . 0.3 OUTLIER -48.69 -29.84 4.87 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.43 0.633 . . . . 0.0 110.0 -179.939 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.433 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.8 OUTLIER -55.2 -24.71 28.58 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.886 178.617 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.82 8.73 5.32 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.462 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.428 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.9 OUTLIER -112.58 -50.83 2.87 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.828 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.428 ' HD3' ' CB ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -119.93 -7.33 9.96 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.69 -179.797 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.433 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 10.2 ttt180 -53.44 -33.59 54.65 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.109 0.48 . . . . 0.0 110.389 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -74.03 -29.69 62.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.508 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.496 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -72.59 -38.95 67.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.461 179.807 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.693 ' HB3' ' CZ3' ' A' ' 48' ' ' TRP . 6.7 mt -70.86 -62.12 1.51 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.9 t -46.48 -29.45 1.76 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.913 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.9 m -73.81 -47.98 34.75 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.163 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.85 -10.7 56.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.024 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.671 ' HG ' ' CZ2' ' A' ' 48' ' ' TRP . 2.2 mm? -89.32 -27.73 20.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.661 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.64 65.51 3.38 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.925 -179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.559 ' C ' HD11 ' A' ' 40' ' ' LEU . 1.3 pp -157.34 -162.89 1.27 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.978 0.418 . . . . 0.0 111.312 -179.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.526 ' O ' HG12 ' A' ' 45' ' ' ILE . 19.4 m-20 -123.07 -177.68 3.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.611 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -58.36 -24.43 59.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.962 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.47 -4.9 33.14 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.623 ' NE2' ' N ' ' A' ' 44' ' ' GLN . 0.9 OUTLIER -120.84 -25.7 5.37 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.951 0.405 . . . . 0.0 109.959 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.692 HD11 ' CZ2' ' A' ' 48' ' ' TRP . 14.7 mm -57.36 -59.35 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.913 0 CA-C-O 121.661 0.743 . . . . 0.0 109.148 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.498 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 0.2 OUTLIER -55.75 -29.42 59.52 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.528 -1.215 . . . . 0.0 110.144 179.612 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.493 ' HB ' ' O ' ' A' ' 44' ' ' GLN . 1.3 mp -59.39 -32.79 49.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.682 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.693 ' CZ3' ' HB3' ' A' ' 34' ' ' LEU . 1.5 m0 -69.97 -63.9 0.99 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.522 0.677 . . . . 0.0 110.112 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.549 ' CZ ' HG22 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -62.31 -28.22 69.58 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.561 -179.441 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.498 ' CB ' ' O ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -62.96 -32.96 74.4 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 178.86 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -86.82 -28.66 22.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.022 178.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.5 tttm -76.21 -26.92 56.6 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.689 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 37.5 mtt180 -58.37 -30.9 67.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.77 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -87.85 -53.28 4.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.061 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 tttt 59.82 31.06 20.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.968 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.7 mt 79.41 68.94 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 121.243 0.544 . . . . 0.0 110.76 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.464 ' O ' ' HG2' ' A' ' 58' ' ' ARG . 43.0 mtt-85 -153.14 -41.88 0.1 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.125 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 0.8 OUTLIER 36.03 53.77 0.93 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.833 -179.994 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.961 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.188 0 N-CA-C 112.517 -0.233 . . . . 0.0 112.517 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -117.54 115.87 25.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.798 0.332 . . . . 0.0 110.935 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.39 51.3 0.35 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.84 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.1 mttm -146.93 51.47 1.1 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.825 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 47.3 mtp180 -111.95 139.41 22.3 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.895 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -86.24 -167.02 0.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.626 2.217 . . . . 0.0 112.392 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -144.96 52.41 1.22 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.264 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.98 -77.84 0.54 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.064 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.407 ' O ' ' HB3' ' A' ' 8' ' ' PHE . . . -59.1 -41.48 88.21 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.818 0.342 . . . . 0.0 110.591 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.51 ' HB2' ' CD2' ' A' ' 13' ' ' LEU . 0.0 OUTLIER 179.11 109.15 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.435 179.546 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.544 ' O ' ' CB ' ' A' ' 10' ' ' SER . 0.0 OUTLIER -98.29 38.57 1.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.681 -179.685 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.544 ' CB ' ' O ' ' A' ' 9' ' ' SER . 4.9 t 94.95 -29.85 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.988 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -79.2 -3.73 47.14 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.753 -179.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.37 -4.48 13.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.805 0.336 . . . . 0.0 111.051 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.601 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -116.09 -27.71 6.83 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.219 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.78 -28.97 68.81 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.834 178.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.3 ttp-105 -70.35 -40.51 74.02 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.463 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.44 -40.79 95.75 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.744 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.611 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -59.26 -46.69 87.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.171 179.493 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -74.17 -32.13 62.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.313 179.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -44.87 92.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.897 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.611 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.8 OUTLIER -87.45 -23.15 24.56 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.921 179.916 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -54.13 -27.95 36.65 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.424 ' O ' HD21 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -86.53 -14.51 42.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.513 179.12 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.599 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.8 OUTLIER -126.2 43.95 2.97 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.503 0.668 . . . . 0.0 110.616 179.247 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.37 -35.51 7.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.572 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.521 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.7 p90 -92.19 -44.34 8.83 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.926 -1.033 . . . . 0.0 111.767 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.599 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.3 OUTLIER -46.32 -27.33 1.01 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.315 0.579 . . . . 0.0 110.969 -179.13 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.1 p -58.57 -19.73 40.68 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.105 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -123.85 -17.72 6.23 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.438 178.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.416 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 4.6 tmt_? -96.21 -53.08 3.75 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-O 120.948 0.404 . . . . 0.0 110.503 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.496 ' HB2' ' HB2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -82.41 -27.82 31.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.392 179.438 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.434 ' HA ' HD11 ' A' ' 34' ' ' LEU . 27.4 ttt180 -49.77 -29.91 8.59 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 178.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -77.62 -32.48 53.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.383 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.511 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.2 OUTLIER -77.84 -40.43 40.32 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.537 179.621 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.614 ' HB3' ' CH2' ' A' ' 48' ' ' TRP . 1.5 mt -63.14 -54.05 43.78 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.082 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.538 ' HA ' HD11 ' A' ' 40' ' ' LEU . 6.1 t -41.72 -30.8 0.25 Allowed 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.734 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.3 m -120.52 14.97 11.99 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.443 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -105.85 -45.25 4.42 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.782 0.289 . . . . 0.0 111.782 -179.871 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.631 ' HG ' ' CD1' ' A' ' 40' ' ' LEU . 0.5 OUTLIER -103.34 14.62 31.1 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -179.114 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.11 69.4 1.29 Allowed Glycine 0 CA--C 1.509 -0.343 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.577 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.631 ' CD1' ' HG ' ' A' ' 38' ' ' LEU . 0.9 OUTLIER -101.25 -164.91 1.15 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.859 0.362 . . . . 0.0 111.873 -179.251 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.4 ' H ' ' NE2' ' A' ' 44' ' ' GLN . 9.5 t30 -126.55 16.55 7.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.038 -178.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.42 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 0.7 OUTLIER 66.9 7.81 5.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.67 0.271 . . . . 0.0 111.28 -179.841 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.62 -29.64 5.7 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.953 0.406 . . . . 0.0 110.533 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.499 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -88.43 -4.32 58.66 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.879 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.681 ' HA ' ' CZ2' ' A' ' 48' ' ' TRP . 9.1 mm -60.41 -58.78 5.8 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.05 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.904 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.488 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 13.8 pttt -62.17 -19.32 62.96 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.909 -1.041 . . . . 0.0 109.631 178.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.499 ' HB ' ' O ' ' A' ' 44' ' ' GLN . 1.7 mp -67.34 -34.89 71.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.681 ' CZ2' ' HA ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -69.82 -60.21 2.45 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 119.903 -0.719 . . . . 0.0 110.238 179.832 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.562 ' CZ ' ' CE3' ' A' ' 48' ' ' TRP . 1.4 m-85 -57.73 -29.78 65.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.385 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.488 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -51.79 -29.83 20.64 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.084 0.469 . . . . 0.0 110.074 178.94 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -86.33 -29.49 22.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.612 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.35 -21.46 42.39 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.069 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.81 36.36 4.54 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.805 0.336 . . . . 0.0 111.099 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -162.12 -56.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.243 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.2 ttmt -86.7 -67.59 0.8 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.995 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.7 mt 78.56 68.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.185 0.517 . . . . 0.0 110.806 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.69 -46.18 0.17 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.681 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -56.83 -31.6 64.92 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.977 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.5 t . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.149 -0.929 . . . . 0.0 110.923 179.967 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.097 0 N-CA-C 112.532 -0.227 . . . . 0.0 112.532 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -125.9 23.63 7.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.771 0.32 . . . . 0.0 111.087 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 61.93 46.18 6.87 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.792 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -158.35 57.65 0.45 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.791 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -91.67 146.75 33.72 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.847 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.6 -165.6 0.18 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.516 2.144 . . . . 0.0 112.282 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.425 ' HA ' ' HB3' ' A' ' 9' ' ' SER . 0.0 OUTLIER -128.9 44.56 2.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.235 0.54 . . . . 0.0 110.487 179.795 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.71 -77.07 0.6 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.731 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.3 -29.0 67.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.633 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.468 ' CG ' ' CD2' ' A' ' 13' ' ' LEU . 0.0 OUTLIER 172.11 114.31 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.178 0.513 . . . . 0.0 110.991 179.505 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.486 ' O ' ' CB ' ' A' ' 10' ' ' SER . 1.4 p -89.3 35.14 0.8 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.909 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.486 ' CB ' ' O ' ' A' ' 9' ' ' SER . 3.4 m 90.16 -30.68 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.484 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -64.86 -36.96 86.02 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.901 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.452 ' CB ' ' HB3' ' A' ' 8' ' ' PHE . 4.6 mt-30 -78.3 -29.65 47.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.934 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.468 ' CD2' ' CG ' ' A' ' 8' ' ' PHE . 11.2 mt -71.05 -33.43 70.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.063 179.149 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.3 -37.14 63.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.704 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.4 tmm_? -80.23 -38.89 30.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.622 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.08 -28.91 70.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.968 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.63 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.1 OUTLIER -58.77 -44.44 90.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.5 179.786 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.05 -31.95 56.58 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.504 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.37 -42.47 87.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.009 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.63 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.6 OUTLIER -87.98 -24.41 23.55 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.061 179.994 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -48.5 -54.45 14.27 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.955 0.407 . . . . 0.0 110.356 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.404 ' O ' ' CE1' ' A' ' 25' ' ' TYR . 1.3 mp0 -73.17 -20.87 60.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.397 179.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.508 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER -102.56 31.62 4.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.295 0.569 . . . . 0.0 109.715 179.505 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -121.83 -38.75 2.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.821 -178.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.45 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 13.0 p90 -89.95 -39.01 13.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.545 -178.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.508 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 1.0 OUTLIER -53.05 -14.63 0.64 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 121.107 0.48 . . . . 0.0 111.089 -179.742 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.441 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -77.5 -20.43 54.31 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.811 179.52 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -133.98 14.18 3.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.116 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.41 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -118.53 -42.73 2.74 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.821 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.72 9.61 3.36 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.411 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.405 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 1.7 ttm180 -71.59 -46.28 59.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.899 0.38 . . . . 0.0 110.624 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -61.95 -27.89 69.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.887 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.481 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -74.73 -39.46 61.86 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.594 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.619 ' HB3' ' CH2' ' A' ' 48' ' ' TRP . 9.8 mt -69.13 -58.49 4.0 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.479 ' HA ' HD23 ' A' ' 40' ' ' LEU . 1.7 t -40.11 -33.22 0.21 Allowed 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.271 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.4 m -77.24 -39.02 49.92 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.303 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -91.18 -9.21 46.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.629 -179.765 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.556 ' HG ' ' CE2' ' A' ' 48' ' ' TRP . 4.3 mm? -99.03 2.93 46.68 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.607 0.242 . . . . 0.0 111.451 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 46.84 70.14 0.74 Allowed Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.992 -0.623 . . . . 0.0 113.072 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.643 ' HB2' ' HB2' ' A' ' 44' ' ' GLN . 1.8 pt? -156.66 -151.45 0.32 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.295 0.569 . . . . 0.0 111.659 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -136.55 -89.49 0.29 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.098 -0.956 . . . . 0.0 111.615 -179.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.414 ' HA ' HG13 ' A' ' 45' ' ' ILE . 14.0 mm-40 -136.97 -46.46 0.58 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.776 0.322 . . . . 0.0 111.605 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.11 -19.15 65.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.751 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.739 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -95.61 -17.07 21.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.973 0.416 . . . . 0.0 110.082 179.838 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.763 HD11 ' CH2' ' A' ' 48' ' ' TRP . 8.3 mm -54.66 -49.48 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 178.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -66.38 -11.11 49.61 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.913 177.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.739 ' HB ' ' O ' ' A' ' 44' ' ' GLN . 1.3 mp -73.67 -33.29 38.05 Favored 'Isoleucine or valine' 0 C--N 1.343 0.29 0 C-N-CA 121.034 -0.266 . . . . 0.0 111.553 -179.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.763 ' CH2' HD11 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -69.11 -60.1 2.58 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.312 179.661 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.626 ' CZ ' ' CE3' ' A' ' 48' ' ' TRP . 1.3 m-85 -57.16 -33.27 67.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.695 -179.282 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.89 -30.15 61.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.08 0.467 . . . . 0.0 109.854 179.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -83.27 -30.22 27.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.997 179.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.87 -28.21 67.33 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.688 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -61.91 -32.95 73.38 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.924 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -90.73 -60.38 1.93 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.081 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.7 mttp 63.76 26.27 14.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.133 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.9 mt 78.94 68.76 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 121.167 0.508 . . . . 0.0 110.848 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.11 -49.2 0.15 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.852 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.99 85.19 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.872 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.4 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.914 -179.982 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 112.456 -0.258 . . . . 0.0 112.456 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -168.69 108.11 0.48 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.78 0.324 . . . . 0.0 110.886 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 63.31 47.08 4.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.786 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -170.3 47.97 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.894 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.1 mmt180 -133.11 146.91 63.11 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.95 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -54.8 -161.52 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.73 2.287 . . . . 0.0 112.48 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.6 ptp85 -127.55 43.71 3.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.544 179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.78 -76.59 0.61 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.978 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -74.21 -26.51 60.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.99 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.522 ' CD2' HD13 ' A' ' 13' ' ' LEU . 0.0 OUTLIER 170.94 113.23 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.019 0.438 . . . . 0.0 111.183 179.818 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.519 ' O ' ' CB ' ' A' ' 10' ' ' SER . 0.0 OUTLIER -95.28 38.58 1.14 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.334 -179.316 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.519 ' CB ' ' O ' ' A' ' 9' ' ' SER . 2.7 m 93.27 -31.0 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.831 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -19.83 65.45 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.173 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.422 ' HB2' ' CB ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -94.66 -44.3 7.88 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.211 179.52 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.522 HD13 ' CD2' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -60.76 -40.15 91.44 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.846 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.45 -21.43 37.0 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.693 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.88 -28.04 36.09 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.893 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -91.94 14.13 16.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.432 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -137.09 0.94 2.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.397 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.0 ttp180 -145.76 -43.37 0.21 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.756 0.312 . . . . 0.0 110.686 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.64 -27.84 66.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.605 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.484 ' CD1' ' C ' ' A' ' 20' ' ' PHE . 0.8 OUTLIER -87.51 -26.7 23.05 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.788 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.449 ' O ' ' CD1' ' A' ' 25' ' ' TYR . 70.6 m-20 -73.22 -3.32 26.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.287 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -120.28 2.22 10.82 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.993 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.444 ' O ' ' CG ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -144.73 8.0 1.28 Allowed 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.89 0.376 . . . . 0.0 111.294 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.462 ' HG3' ' CA ' ' A' ' 20' ' ' PHE . 12.1 mtt180 -133.28 -55.95 0.91 Allowed 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.161 0.505 . . . . 0.0 110.69 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.485 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 1.3 p90 -37.78 -34.37 0.11 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.277 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.485 ' N ' ' CD1' ' A' ' 25' ' ' TYR . 2.2 pt? -51.58 -28.67 14.69 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.206 -178.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.454 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 2.5 p -70.83 -14.96 62.6 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.972 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -136.92 15.68 3.07 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.09 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' A' ' 25' ' ' TYR . 16.4 tpt85 -121.62 -48.07 2.18 Favored 'General case' 0 C--O 1.23 0.055 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.579 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.91 -14.28 8.96 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.553 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.454 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 1.7 ttm180 -56.92 -22.49 37.96 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.672 0.273 . . . . 0.0 110.968 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -84.11 -25.17 29.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.048 0.451 . . . . 0.0 109.98 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.91 -44.09 15.77 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.044 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.566 HD22 ' CH2' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -64.35 -59.52 4.27 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 178.788 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.1 t -39.13 -33.04 0.11 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.374 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 12.9 m -78.88 -28.35 44.1 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.163 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 34' ' ' LEU . 3.0 tt0 -73.42 -60.63 2.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.877 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.592 HD21 HD13 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -56.57 -49.77 73.88 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 121.05 0.453 . . . . 0.0 110.329 179.756 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 108.95 46.26 0.96 Allowed Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.721 -179.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.592 HD13 HD21 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -130.17 -160.38 1.03 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.113 0.482 . . . . 0.0 111.413 -179.322 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -118.69 -88.76 0.61 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.675 -0.693 . . . . 0.0 112.068 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -141.04 -46.14 0.39 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.76 0.314 . . . . 0.0 111.1 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.432 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -65.98 -12.89 58.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.165 179.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.491 ' H ' ' NE2' ' A' ' 44' ' ' GLN . 0.3 OUTLIER -101.14 -20.27 15.39 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.485 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.767 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 41.9 mm -57.58 -60.58 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.482 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -58.02 -16.79 13.9 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.704 178.958 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.432 ' CD1' ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -77.37 -36.08 23.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -178.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.767 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -78.8 -31.69 46.07 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 118.653 -1.219 . . . . 0.0 111.777 -179.354 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.735 ' CE1' ' CZ3' ' A' ' 48' ' ' TRP . 4.9 m-85 -65.54 -42.49 91.88 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.064 178.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.42 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 6.5 pt20 -61.18 -28.4 69.11 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.741 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -85.92 -29.89 23.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.949 178.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -29.71 67.85 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.595 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.08 -30.41 17.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.869 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.81 -27.25 65.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.232 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.46 ' O ' ' CG2' ' A' ' 56' ' ' ILE . 0.1 OUTLIER -56.73 -28.1 60.43 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.1 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.46 ' CG2' ' O ' ' A' ' 55' ' ' LYS . 7.5 tt 47.16 36.14 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 CA-C-O 121.417 0.627 . . . . 0.0 110.892 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -174.1 -41.4 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.891 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 43.94 35.39 1.12 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.451 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.3 t . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.895 179.985 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.219 0 N-CA-C 112.486 -0.246 . . . . 0.0 112.486 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -154.89 96.2 1.83 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.898 0.38 . . . . 0.0 110.859 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -169.26 57.36 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.831 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -177.33 66.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.757 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.07 137.69 19.3 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.799 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -79.95 -175.88 2.94 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.595 2.197 . . . . 0.0 112.354 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.1 ttt-85 -142.72 45.38 1.6 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.061 0.458 . . . . 0.0 110.918 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.1 m -167.19 -49.57 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.277 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.641 ' O ' ' CD1' ' A' ' 8' ' ' PHE . . . -49.72 -26.59 3.92 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.813 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.641 ' CD1' ' O ' ' A' ' 7' ' ' ALA . 2.6 m-30 145.92 118.25 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 O-C-N 124.132 0.895 . . . . 0.0 111.067 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.492 ' O ' ' CB ' ' A' ' 10' ' ' SER . 25.1 t -153.93 31.89 0.44 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.25 178.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.492 ' CB ' ' O ' ' A' ' 9' ' ' SER . 5.1 t 90.39 -28.8 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.849 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -83.09 -37.37 23.91 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.503 -0.772 . . . . 0.0 111.354 -179.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.18 -18.48 46.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.2 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.421 HD21 ' CG ' ' A' ' 8' ' ' PHE . 0.1 OUTLIER -95.91 -25.91 15.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.748 0.308 . . . . 0.0 110.522 179.553 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.59 -30.04 25.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.863 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -37.02 72.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.841 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.78 -40.86 94.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.088 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.592 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -60.14 -48.05 83.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.505 179.739 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.63 -31.95 63.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.332 179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -64.06 -46.24 85.21 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.219 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.592 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.9 OUTLIER -85.17 -23.71 28.24 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.1 -179.979 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -52.35 -25.6 10.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.954 0.407 . . . . 0.0 110.552 179.225 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -96.0 -10.84 27.55 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.3 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.468 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.7 OUTLIER -128.67 39.29 3.83 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.851 0.358 . . . . 0.0 111.385 179.91 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.413 ' O ' HG22 ' A' ' 27' ' ' THR . 0.0 OUTLIER -124.91 -38.5 2.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.308 0.575 . . . . 0.0 111.0 -179.548 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.476 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 15.9 p90 -83.54 -40.7 18.81 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.0 -179.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.476 ' N ' ' CG ' ' A' ' 25' ' ' TYR . 2.2 pt? -47.76 -28.22 2.4 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.357 0.598 . . . . 0.0 110.536 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.414 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 1.2 p -58.2 -23.91 57.29 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.783 178.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -130.31 21.39 5.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.703 178.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.54 -51.24 1.38 Allowed 'General case' 0 C--O 1.231 0.087 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.94 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -131.26 4.29 4.36 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.855 -179.681 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 26' ' ' LEU . 2.9 ttt180 -58.61 -26.42 63.66 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.871 0.367 . . . . 0.0 110.667 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.94 -21.11 34.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.055 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.95 -37.95 15.97 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.635 -0.712 . . . . 0.0 109.52 179.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.515 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 0.5 OUTLIER -65.37 -49.27 69.95 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.672 178.97 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.91 -27.09 1.97 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.092 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.99 -11.9 27.66 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.601 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.403 ' N ' ' O ' ' A' ' 34' ' ' LEU . 9.6 tp10 -76.91 -62.51 1.62 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.638 0.256 . . . . 0.0 110.955 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.483 HD23 ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -69.15 -47.63 64.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.187 0.518 . . . . 0.0 110.177 179.528 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 124.68 2.54 8.03 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.501 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.456 HD23 ' CD1' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -102.15 -165.42 1.18 Allowed 'General case' 0 CA--C 1.527 0.093 0 CA-C-O 121.095 0.474 . . . . 0.0 111.396 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.514 ' O ' HG12 ' A' ' 45' ' ' ILE . 17.4 t30 -113.76 166.91 11.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.314 -179.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.524 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 91.4 mt-10 -53.07 -28.31 24.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.479 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.412 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -63.82 -48.92 74.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.982 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.491 ' HA ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -87.11 -15.09 39.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.225 179.414 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.948 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 2.5 mm -59.94 -58.62 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.529 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 0.2 OUTLIER -57.32 -18.15 15.66 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.1 178.012 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.491 ' HB ' ' HA ' ' A' ' 44' ' ' GLN . 1.2 mp -79.39 -48.39 21.14 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 -178.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.948 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 34.0 p-90 -63.91 -25.84 68.33 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 119.392 -0.923 . . . . 0.0 112.177 -177.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.661 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 27.5 m-85 -66.33 -53.1 40.17 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 177.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.423 ' CG ' ' O ' ' A' ' 47' ' ' ILE . 1.7 pt20 -53.03 -26.49 15.86 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.252 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -87.23 -30.32 21.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.024 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.59 -28.51 63.86 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.738 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.55 -29.09 19.16 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.053 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.36 -15.74 59.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.48 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -100.45 25.48 7.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.078 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.1 tt -140.5 42.1 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.146 0.498 . . . . 0.0 111.04 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.4 mtp180 -148.31 -46.76 0.15 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.848 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -69.6 0.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.897 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.4 t . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.276 -0.869 . . . . 0.0 110.861 180.0 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -162.65 31.81 0.1 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.799 0.333 . . . . 0.0 110.906 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -160.89 55.9 0.31 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.849 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.453 ' O ' ' O ' ' A' ' 3' ' ' ARG . 0.1 OUTLIER -144.65 48.06 1.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.827 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.548 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 4.7 ptt-85 47.79 112.34 0.0 OUTLIER Pre-proline 0 CA--C 1.534 0.33 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.091 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 6.6 Cg_exo -74.22 -160.09 0.1 OUTLIER 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.973 2.448 . . . . 0.0 112.209 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -128.47 44.77 2.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.285 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.413 ' CG2' ' N ' ' A' ' 7' ' ' ALA . 5.3 t -120.48 -45.63 2.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.497 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.413 ' N ' ' CG2' ' A' ' 6' ' ' THR . . . -167.45 -38.15 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.08 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.496 ' CD2' ' CD2' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -72.61 59.39 0.45 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.809 179.53 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.53 ' O ' ' CB ' ' A' ' 10' ' ' SER . 1.1 p -107.53 37.18 2.48 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.09 0.471 . . . . 0.0 110.745 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 9' ' ' SER . 4.7 m 96.92 -30.82 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.603 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -74.68 -50.41 17.69 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.193 -179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.86 -19.02 65.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.398 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.496 ' CD2' ' CD2' ' A' ' 8' ' ' PHE . 0.1 OUTLIER -98.42 -26.08 14.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.836 0.351 . . . . 0.0 110.479 179.792 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.72 -29.13 25.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.642 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -83.56 -35.29 24.87 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.746 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.97 -38.75 83.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.911 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.8 OUTLIER -57.67 -45.1 85.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.257 179.576 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.411 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 10.5 ttp85 -74.36 -32.67 62.85 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.528 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.49 -32.84 73.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.288 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.552 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.4 OUTLIER -105.06 -15.37 15.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.719 0.295 . . . . 0.0 111.35 -179.847 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.411 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -47.83 -34.16 8.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.905 0.383 . . . . 0.0 110.862 179.646 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.451 ' O ' ' CD2' ' A' ' 26' ' ' LEU . 15.5 mt-10 -83.59 -16.37 45.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.872 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.503 ' HA ' ' CG ' ' A' ' 26' ' ' LEU . 1.7 m-80 -98.92 30.93 3.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.514 0.673 . . . . 0.0 109.784 179.411 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.6 -20.68 15.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.275 -179.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.514 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 12.4 p90 -116.26 -44.6 2.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.487 -178.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.514 ' N ' ' CG ' ' A' ' 25' ' ' TYR . 0.5 OUTLIER -48.98 -27.11 2.91 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.304 0.574 . . . . 0.0 110.382 -179.811 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -59.53 -24.0 63.32 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.839 178.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -130.93 0.29 4.25 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.996 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.85 -29.54 6.35 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.988 0.423 . . . . 0.0 110.997 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.5 ' HB3' ' HB2' ' A' ' 26' ' ' LEU . 6.6 ttm180 -115.89 -24.39 8.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.895 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 26' ' ' LEU . 32.4 ttp180 -49.47 -31.57 10.25 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.188 0.518 . . . . 0.0 110.161 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -38.29 73.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.973 179.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.453 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.6 OUTLIER -78.02 -37.11 47.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.94 179.219 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.6 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 4.0 mt -67.41 -41.73 84.4 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.519 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.413 ' N ' HD11 ' A' ' 45' ' ' ILE . 3.4 t -55.66 -26.92 47.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.649 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -112.05 3.13 17.17 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.101 179.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -85.57 -48.03 9.31 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.024 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.59 HD12 HD11 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -96.34 -31.92 12.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.797 0.332 . . . . 0.0 110.479 179.645 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 104.31 46.28 1.35 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.546 -0.835 . . . . 0.0 113.315 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.59 HD11 HD12 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -127.25 -163.95 1.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.979 0.419 . . . . 0.0 111.331 179.227 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.413 ' O ' HG12 ' A' ' 45' ' ' ILE . 1.0 OUTLIER -97.96 148.64 23.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.017 -179.176 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -53.77 -40.45 66.27 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.099 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.96 -31.12 65.99 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 121.755 0.788 . . . . 0.0 109.247 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.502 ' NE2' HD22 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -77.73 -14.82 59.49 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.177 -1.374 . . . . 0.0 110.273 -179.832 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.804 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 5.9 mm -63.29 -57.19 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.46 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -58.39 -16.53 15.14 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.917 177.795 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.472 ' O ' ' HG2' ' A' ' 50' ' ' GLN . 1.2 mp -79.39 -39.64 20.98 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.143 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -178.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.804 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 27.1 p-90 -74.06 -27.54 60.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 118.732 -1.187 . . . . 0.0 112.319 -178.06 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.649 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 7.4 m-85 -68.48 -46.29 70.1 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.9 pt20 -60.54 -25.6 66.26 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.829 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -88.21 -31.37 19.12 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.985 178.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.53 -28.2 63.72 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.76 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.99 -39.78 14.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.929 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.65 -56.73 4.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.103 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.2 mttp 61.49 33.79 18.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.989 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -140.39 42.77 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.187 0.518 . . . . 0.0 110.994 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -122.05 -39.12 2.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.892 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.36 -31.02 63.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.994 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.201 -0.905 . . . . 0.0 110.938 179.921 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.452 -0.259 . . . . 0.0 112.452 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -122.02 177.47 5.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.812 0.339 . . . . 0.0 110.893 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 62.87 46.9 4.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.7 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.67 46.56 1.78 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.926 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.423 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 3.9 mtm-85 -106.6 130.55 22.74 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.661 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 37.1 Cg_exo -61.81 -162.49 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.397 2.064 . . . . 0.0 112.283 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.446 ' O ' ' HB ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -122.85 22.67 9.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.831 179.015 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.446 ' HB ' ' O ' ' A' ' 5' ' ' ARG . 11.0 t 176.14 -50.9 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.455 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.438 ' N ' ' CG2' ' A' ' 6' ' ' THR . . . 165.91 38.65 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.024 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.519 ' CG ' HD23 ' A' ' 13' ' ' LEU . 0.4 OUTLIER -145.89 94.33 2.47 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.783 -179.765 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.597 ' C ' ' H ' ' A' ' 11' ' ' GLU . 3.2 p -80.7 31.37 0.3 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -178.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.408 ' H ' ' C ' ' A' ' 8' ' ' PHE . 7.5 m 72.6 -26.79 0.18 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.859 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.597 ' H ' ' C ' ' A' ' 9' ' ' SER . 9.8 mt-10 -72.54 -49.26 33.91 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.564 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.455 ' HB3' ' CE1' ' A' ' 8' ' ' PHE . 0.9 OUTLIER -53.65 -29.05 36.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.32 179.397 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.519 HD23 ' CG ' ' A' ' 8' ' ' PHE . 0.6 OUTLIER -75.6 -33.71 60.56 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.073 179.386 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.88 -32.83 65.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.017 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.1 ttp180 -86.8 -29.19 22.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.438 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -79.42 -3.74 47.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.115 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.482 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.3 OUTLIER -96.75 -55.51 2.87 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.318 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.4 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 43.2 ttp85 -64.54 -30.56 71.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.898 178.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.404 ' O ' ' ND2' ' A' ' 23' ' ' ASN . 0.3 OUTLIER -54.58 -27.43 38.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.779 179.799 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.496 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 4.1 p90 -118.72 -30.52 5.09 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.399 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.4 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 0.7 OUTLIER -48.76 -28.17 3.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.785 0.326 . . . . 0.0 110.877 179.865 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.426 ' C ' ' CD2' ' A' ' 26' ' ' LEU . 7.4 tm-20 -108.17 22.05 16.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.951 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.494 ' ND2' ' N ' ' A' ' 23' ' ' ASN . 0.0 OUTLIER -163.73 31.38 0.08 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.27 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.496 ' HB3' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -126.75 -44.1 1.68 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.117 0.484 . . . . 0.0 110.905 -179.358 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.538 ' CE1' HD23 ' A' ' 26' ' ' LEU . 15.4 p90 -93.35 -45.94 7.58 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.096 -179.112 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.538 HD23 ' CE1' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -51.16 -27.28 8.29 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.325 0.583 . . . . 0.0 110.124 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.4 p -59.52 -21.87 60.82 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.94 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -131.37 1.32 4.14 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.712 178.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -115.91 -31.59 5.71 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 120.948 0.404 . . . . 0.0 111.009 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.417 ' HB3' ' HB2' ' A' ' 26' ' ' LEU . 4.8 ttt85 -117.57 -23.62 7.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.275 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.429 ' N ' ' O ' ' A' ' 26' ' ' LEU . 34.7 ttp180 -50.74 -30.06 12.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.045 0.45 . . . . 0.0 110.615 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.46 -31.1 62.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.338 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.475 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.3 OUTLIER -75.86 -37.53 58.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.408 179.615 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.653 ' HB3' ' CH2' ' A' ' 48' ' ' TRP . 6.9 mt -68.29 -62.7 1.28 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 39.5 t -43.06 -30.17 0.41 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.196 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.6 t -79.18 -38.72 35.18 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.265 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.64 -15.81 31.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.074 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.687 ' HG ' ' CZ2' ' A' ' 48' ' ' TRP . 2.7 mm? -88.98 -27.58 20.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.631 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 58.91 65.52 3.43 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.719 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.556 ' HG ' ' HB3' ' A' ' 38' ' ' LEU . 0.5 OUTLIER -154.66 -164.78 1.9 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.993 0.425 . . . . 0.0 111.577 -178.889 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.449 ' O ' ' NE2' ' A' ' 44' ' ' GLN . 35.5 t30 -118.97 172.07 7.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.321 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.4 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 5.5 mt-10 -53.39 -23.53 9.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.678 0.275 . . . . 0.0 111.469 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.415 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -70.1 -9.45 55.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.933 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.622 ' NE2' ' N ' ' A' ' 44' ' ' GLN . 1.1 mp0 -117.32 -26.65 6.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.053 0.454 . . . . 0.0 109.78 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.712 HD13 ' CZ2' ' A' ' 48' ' ' TRP . 12.9 mm -57.41 -59.26 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.417 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -55.9 -25.54 43.33 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.129 179.281 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.544 ' HB ' ' O ' ' A' ' 44' ' ' GLN . 1.2 mp -62.89 -32.51 56.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.748 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.712 ' CZ2' HD13 ' A' ' 45' ' ' ILE . 1.1 m0 -70.89 -63.93 1.0 Allowed 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.523 0.678 . . . . 0.0 110.229 179.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.515 ' CZ ' ' CE3' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -61.97 -24.22 66.88 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.82 -179.244 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.3 mt-30 -56.88 -29.15 62.68 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -88.32 -27.78 21.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.211 179.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.91 -27.27 49.48 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.794 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.62 31.89 6.42 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.909 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -103.79 -60.59 1.55 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.065 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 18.2 mtmm -136.29 -46.92 0.63 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.951 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.8 mt 80.17 69.12 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 121.202 0.525 . . . . 0.0 110.814 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.21 -42.31 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.934 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? 60.58 98.66 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.748 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.286 -0.864 . . . . 0.0 110.85 -179.911 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 112.596 -0.202 . . . . 0.0 112.596 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 18.9 p30 -154.75 167.69 29.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 0.0 110.875 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -158.3 51.48 0.42 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.938 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.09 66.59 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.1 ptt-85 -79.49 139.45 55.26 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.797 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -82.12 -167.18 0.45 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.618 2.212 . . . . 0.0 112.592 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.61 45.12 2.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.43 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.439 ' CG2' ' N ' ' A' ' 7' ' ' ALA . 7.2 t -125.03 -48.55 1.74 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.442 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.439 ' N ' ' CG2' ' A' ' 6' ' ' THR . . . -138.87 25.64 2.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.381 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.509 ' CE1' ' HB3' ' A' ' 13' ' ' LEU . 1.7 m-85 -145.02 72.81 1.34 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.805 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.496 ' O ' ' CB ' ' A' ' 10' ' ' SER . 0.6 OUTLIER -103.33 32.75 3.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.165 0.507 . . . . 0.0 111.208 -179.795 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.496 ' CB ' ' O ' ' A' ' 9' ' ' SER . 5.5 t 89.73 -27.67 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.048 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -89.72 -9.66 48.61 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.868 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -103.91 -17.63 14.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.634 0.254 . . . . 0.0 111.383 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.509 ' HB3' ' CE1' ' A' ' 8' ' ' PHE . 0.6 OUTLIER -106.08 -22.99 12.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.006 0.432 . . . . 0.0 110.286 179.24 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.54 -17.74 57.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.665 178.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.41 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 4.5 mtt180 -61.53 -30.11 70.43 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.109 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -76.44 -1.43 27.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.835 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.465 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.2 OUTLIER -126.59 -15.58 5.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.721 -0.218 . . . . 0.0 111.401 -179.75 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -110.12 -37.11 5.66 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.707 0.289 . . . . 0.0 111.201 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 5.2 mm-40 -62.66 -35.14 78.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.082 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.694 ' HA ' ' OD1' ' A' ' 23' ' ' ASN . 0.5 OUTLIER -91.86 -23.12 19.76 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.904 -0.318 . . . . 0.0 110.944 179.836 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.411 ' ND2' ' O ' ' A' ' 17' ' ' LYS . 0.3 OUTLIER -55.3 -24.96 31.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.005 0.431 . . . . 0.0 110.155 179.155 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -91.6 -2.29 57.17 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.092 179.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.694 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -132.6 38.63 3.41 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-O 121.568 0.699 . . . . 0.0 110.677 179.4 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -93.66 -48.69 6.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.175 179.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.511 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 10.8 p90 -70.69 -43.84 68.21 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.682 -1.144 . . . . 0.0 111.696 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.675 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 1.2 pp -53.87 -20.64 6.23 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.201 0.524 . . . . 0.0 110.754 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.487 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 3.3 p -65.82 -19.06 65.75 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.037 178.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -135.08 16.29 3.5 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.726 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.5 -51.41 2.4 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.639 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.507 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -132.81 7.88 4.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.467 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.487 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 47.3 ttt180 -80.06 -2.37 44.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.903 0.382 . . . . 0.0 110.867 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -97.59 -28.91 13.73 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -69.78 -35.33 74.8 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.56 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.658 ' HB3' ' CH2' ' A' ' 48' ' ' TRP . 0.3 OUTLIER -66.31 -63.87 0.98 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.446 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.451 ' HB2' HD12 ' A' ' 45' ' ' ILE . 17.8 t -40.3 -31.79 0.15 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.943 -1.026 . . . . 0.0 111.539 179.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.47 -36.98 21.91 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.946 -179.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -85.09 -19.37 31.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.894 0.378 . . . . 0.0 111.07 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.5 ' HB2' HD13 ' A' ' 40' ' ' LEU . 4.4 mm? -78.3 -49.98 12.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.779 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 104.48 21.22 9.45 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.718 -0.673 . . . . 0.0 111.818 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.5 HD13 ' HB2' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -109.02 -160.54 0.72 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.163 0.506 . . . . 0.0 111.101 -179.847 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -120.84 -101.04 0.42 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.486 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -129.63 -42.62 1.29 Allowed 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.722 0.296 . . . . 0.0 111.516 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.404 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -73.36 -2.78 23.58 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.763 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.506 ' NE2' ' N ' ' A' ' 44' ' ' GLN . 0.9 OUTLIER -106.02 -23.29 12.68 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.407 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.667 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 38.5 mm -56.8 -61.21 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.869 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -15.37 11.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.796 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.432 ' HB ' ' HA ' ' A' ' 44' ' ' GLN . 1.4 mp -79.11 -36.19 18.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -178.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.707 ' CZ3' ' CE1' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -78.68 -29.65 45.74 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 118.463 -1.295 . . . . 0.0 111.902 -179.155 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.707 ' CE1' ' CZ3' ' A' ' 48' ' ' TRP . 4.5 m-85 -69.41 -42.19 75.4 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 119.683 -0.807 . . . . 0.0 109.187 178.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.429 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 5.8 pt20 -60.81 -28.77 69.03 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.968 179.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -89.7 -28.35 19.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.056 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 33.5 tttt -78.74 -23.73 45.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.873 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -97.7 23.76 7.51 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.03 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -86.85 -43.55 12.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.118 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.405 ' O ' ' HB ' ' A' ' 56' ' ' ILE . 3.0 mptm? 62.3 33.34 16.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.873 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.405 ' HB ' ' O ' ' A' ' 55' ' ' LYS . 3.8 mt 80.81 69.32 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.873 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -117.19 -38.72 3.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.809 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -60.44 -69.71 0.21 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.822 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.3 p . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.955 -179.918 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.201 0 N-CA-C 112.488 -0.245 . . . . 0.0 112.488 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 2.3 t70 60.33 35.84 20.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.818 0.342 . . . . 0.0 110.919 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -151.95 49.95 0.79 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.912 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -160.12 56.75 0.36 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.878 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.9 mmm180 61.56 156.2 0.11 Allowed Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.73 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.21 -167.16 0.12 Allowed 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.425 2.084 . . . . 0.0 112.233 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.9 ptp180 -164.92 61.46 0.13 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.031 0.443 . . . . 0.0 110.865 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.8 m -165.4 -48.61 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.225 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.627 ' O ' ' CD1' ' A' ' 8' ' ' PHE . . . -50.87 -26.11 5.4 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.81 179.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.627 ' CD1' ' O ' ' A' ' 7' ' ' ALA . 2.5 m-30 144.95 118.45 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.377 0 O-C-N 124.201 0.938 . . . . 0.0 110.99 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.498 ' O ' ' CB ' ' A' ' 10' ' ' SER . 29.5 t -158.26 32.2 0.24 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.076 0.465 . . . . 0.0 111.394 178.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.498 ' CB ' ' O ' ' A' ' 9' ' ' SER . 3.1 m 90.68 -29.34 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.924 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -81.64 -37.94 26.74 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.584 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.67 -19.73 41.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.321 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.53 -26.65 15.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.796 0.332 . . . . 0.0 110.438 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.24 -29.48 31.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.936 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -40.72 97.5 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.018 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.31 -43.73 96.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.842 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.598 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 26.6 mtmt -63.02 -52.12 64.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.168 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 48.5 ttp85 -65.59 -31.67 72.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.547 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -65.6 -46.36 79.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.077 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.598 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.8 OUTLIER -88.22 -24.68 23.21 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.232 -179.875 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -48.45 -40.43 26.22 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.895 0.379 . . . . 0.0 110.712 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -92.21 -16.94 25.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.826 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.518 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER -103.02 32.66 3.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.311 0.577 . . . . 0.0 109.855 179.772 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.66 -40.74 2.31 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.625 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.428 ' C ' ' H ' ' A' ' 27' ' ' THR . 7.9 p90 -89.91 -36.71 14.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.292 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.518 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -54.05 -11.48 0.46 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.092 0.473 . . . . 0.0 111.183 -179.889 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.46 ' N ' HD22 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -81.82 -20.67 38.57 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.779 179.654 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -132.97 11.38 4.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.107 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.04 -42.11 2.04 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.809 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.4 ' HD3' ' CB ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -112.44 -14.82 13.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.362 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 ttm180 -51.78 -30.84 24.52 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.069 0.461 . . . . 0.0 110.399 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.3 -48.05 18.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.17 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.406 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -61.3 -33.52 73.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.231 0.538 . . . . 0.0 109.817 179.2 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.653 HD21 ' CZ2' ' A' ' 48' ' ' TRP . 5.1 mt -67.88 -57.27 6.52 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.515 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.46 -23.72 10.91 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.244 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.97 -27.67 23.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.387 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -111.08 29.49 7.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.785 0.326 . . . . 0.0 111.286 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.477 ' HB3' ' CD1' ' A' ' 40' ' ' LEU . 1.0 OUTLIER -132.7 -56.33 0.94 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.239 0.542 . . . . 0.0 110.673 179.75 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 121.11 3.28 10.75 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.494 -0.776 . . . . 0.0 112.009 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.501 ' HB3' ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -94.22 -158.66 0.64 Allowed 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.329 0.585 . . . . 0.0 111.234 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -119.06 -59.82 1.81 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.494 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 174.72 -42.2 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.432 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -72.52 -12.04 60.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.288 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.548 ' H ' ' NE2' ' A' ' 44' ' ' GLN . 1.4 mp0 -101.28 -15.78 17.17 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.911 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 2.7 mm -63.02 -58.74 6.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.765 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.457 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.46 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 2.6 mtmt -56.97 -19.09 16.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.047 178.028 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.526 ' O ' ' HG2' ' A' ' 50' ' ' GLN . 1.2 mp -78.12 -47.25 25.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 113.75 1.019 . . . . 0.0 113.75 -178.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.911 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 40.9 p-90 -65.53 -25.06 67.28 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 119.171 -1.012 . . . . 0.0 112.176 -177.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.683 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 23.3 m-85 -69.14 -53.96 17.4 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 176.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.4 pt20 -57.04 -28.52 62.59 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.9 179.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -84.66 -29.66 25.5 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.883 178.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -67.94 -29.7 68.83 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.558 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.03 30.49 6.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.83 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -106.1 -61.33 1.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.177 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.449 ' O ' ' CG2' ' A' ' 56' ' ' ILE . 9.4 mmpt? -76.32 -60.94 2.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.805 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.449 ' CG2' ' O ' ' A' ' 55' ' ' LYS . 0.6 OUTLIER 46.92 36.2 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 CA-C-O 121.484 0.659 . . . . 0.0 110.849 -179.717 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -148.2 -66.57 0.24 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.939 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 58.07 30.86 19.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.995 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.873 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.554 -0.219 . . . . 0.0 112.554 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.2 -28.2 69.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.742 0.305 . . . . 0.0 110.919 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -137.26 46.78 2.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.894 0.378 . . . . 0.0 110.839 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -173.7 64.9 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.833 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.07 136.15 62.0 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.8 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.459 ' HB3' ' CB ' ' A' ' 9' ' ' SER . 84.0 Cg_endo -86.51 -165.36 0.25 Allowed 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.737 2.291 . . . . 0.0 112.366 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.0 ptt180 -117.79 37.96 3.78 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 121.262 0.553 . . . . 0.0 110.771 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.452 ' O ' ' CB ' ' A' ' 7' ' ' ALA . 23.7 m -147.76 -62.6 0.27 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.257 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 6' ' ' THR . . . 158.08 -19.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.364 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.485 ' CG ' ' CD2' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -141.57 96.47 2.99 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.83 179.315 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.492 ' C ' ' H ' ' A' ' 11' ' ' GLU . 12.7 p -69.75 42.71 0.05 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.292 -178.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.449 ' H ' ' C ' ' A' ' 8' ' ' PHE . 5.7 t 79.8 -28.29 0.14 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.324 0.583 . . . . 0.0 110.3 -179.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.492 ' H ' ' C ' ' A' ' 9' ' ' SER . 3.6 tp10 -65.22 -45.75 83.44 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.672 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.457 ' CB ' ' HB3' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -68.41 -31.77 71.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.882 178.925 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.485 ' CD2' ' CG ' ' A' ' 8' ' ' PHE . 12.6 mt -67.84 -33.61 75.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.629 178.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.41 -33.1 60.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.926 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.43 -42.52 96.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.622 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.05 -37.34 86.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.795 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.606 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 5.1 mtmt -59.21 -46.09 89.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.241 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.4 ttp85 -70.95 -33.81 70.85 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.461 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -66.81 -49.68 65.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.887 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.607 ' HA ' ' OD1' ' A' ' 23' ' ' ASN . 0.4 OUTLIER -84.34 -15.92 44.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.013 179.876 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -48.14 -29.82 4.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.127 0.489 . . . . 0.0 109.724 178.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.436 ' O ' ' CD2' ' A' ' 26' ' ' LEU . 20.6 mt-10 -84.57 -32.33 23.86 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.313 179.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.607 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.8 OUTLIER -105.72 36.25 2.6 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 121.887 0.851 . . . . 0.0 109.632 178.796 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.424 ' HB2' ' CE1' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -101.95 -27.91 12.69 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.288 -1.324 . . . . 0.0 110.868 -179.982 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.513 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.0 p90 -107.45 -44.81 4.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.85 -178.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.513 ' N ' ' CG ' ' A' ' 25' ' ' TYR . 1.1 pp -50.61 -26.21 5.09 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.237 0.541 . . . . 0.0 110.601 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.436 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 1.2 p -65.39 -19.5 65.97 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.331 -0.849 . . . . 0.0 109.768 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -133.73 7.44 3.79 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.248 178.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.428 ' N ' ' O ' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -110.81 -50.37 2.96 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.394 179.99 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -117.74 -9.02 10.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.207 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 26' ' ' LEU . 4.5 ttp85 -54.08 -27.91 35.75 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.968 0.413 . . . . 0.0 110.589 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -82.65 -27.63 31.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.628 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.52 -40.1 43.84 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.921 179.054 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.584 ' O ' ' N ' ' A' ' 37' ' ' GLU . 0.2 OUTLIER -64.25 -59.5 4.33 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.574 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.6 t -38.75 -32.82 0.09 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.353 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.7 m -80.49 -27.1 37.86 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.448 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.584 ' N ' ' O ' ' A' ' 34' ' ' LEU . 8.9 tm-20 -73.74 -61.26 1.9 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.884 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.527 HD23 HD12 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -53.88 -53.25 55.15 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.105 0.478 . . . . 0.0 110.396 179.783 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.55 36.09 1.64 Allowed Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.595 -179.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.527 HD12 HD23 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -117.57 -160.53 0.78 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.144 0.497 . . . . 0.0 111.398 -179.442 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -118.62 -101.32 0.43 Allowed 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.645 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -128.14 -44.22 1.45 Allowed 'General case' 0 C--O 1.231 0.098 0 CA-C-O 120.689 0.281 . . . . 0.0 111.636 -179.237 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.56 -2.79 21.21 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.788 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.5 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 0.8 OUTLIER -106.57 -21.99 12.9 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.347 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.739 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 42.1 mm -58.03 -61.57 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 178.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -57.68 -16.45 10.78 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.667 178.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.424 ' HB ' ' O ' ' A' ' 44' ' ' GLN . 1.3 mp -76.3 -39.96 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -178.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.739 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -74.23 -41.44 61.33 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 118.797 -1.161 . . . . 0.0 111.846 -179.111 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.696 ' CE1' ' CZ3' ' A' ' 48' ' ' TRP . 2.1 m-85 -57.57 -34.3 69.06 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 119.425 -0.91 . . . . 0.0 108.968 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -50.79 -28.22 8.85 Favored 'General case' 0 C--O 1.231 0.081 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.948 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -87.44 -30.99 20.28 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.264 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.43 -27.81 56.38 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.712 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.1 mtp85 -108.38 29.96 6.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.841 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -93.89 -64.54 1.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.08 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -142.68 -68.26 0.36 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.885 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.2 mt 79.83 69.13 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 121.186 0.517 . . . . 0.0 110.77 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -177.05 -47.12 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.637 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.08 69.4 0.73 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.896 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.952 179.943 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.097 0 N-CA-C 112.594 -0.202 . . . . 0.0 112.594 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -136.49 160.93 37.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.815 0.34 . . . . 0.0 110.916 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -143.95 47.39 1.43 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.77 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -156.48 50.95 0.51 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.843 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.474 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 17.8 mtt85 -134.98 116.59 12.42 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.04 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 6.3 Cg_exo -79.43 -164.09 0.26 Allowed 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.023 2.482 . . . . 0.0 112.186 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -157.02 57.59 0.52 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.554 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.446 ' CG2' ' N ' ' A' ' 7' ' ' ALA . 9.8 t -144.88 -50.88 0.27 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.993 0.425 . . . . 0.0 111.254 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.446 ' N ' ' CG2' ' A' ' 6' ' ' THR . . . -100.54 -56.36 2.36 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.744 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.49 ' CD1' ' N ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER 170.44 113.48 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.26 179.709 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.498 ' O ' ' CB ' ' A' ' 10' ' ' SER . 1.4 p -88.97 35.88 0.8 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -179.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.498 ' CB ' ' O ' ' A' ' 9' ' ' SER . 2.9 m 90.51 -30.98 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.529 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -64.1 -35.45 80.78 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.74 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.429 ' CB ' ' HB3' ' A' ' 8' ' ' PHE . 1.9 mt-30 -81.19 -28.8 34.79 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.935 179.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.47 ' CD2' ' CG ' ' A' ' 8' ' ' PHE . 10.1 mt -72.94 -37.59 67.11 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.88 179.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.94 -36.42 72.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.785 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -74.47 -47.86 30.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.663 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.26 -36.18 79.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.793 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.537 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 9.5 ttmt -59.91 -49.35 78.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.201 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.48 -32.36 69.86 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.44 179.47 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -64.95 -42.69 94.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.268 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.537 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.8 OUTLIER -94.67 -22.43 18.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.513 -179.715 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.4 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 0.4 OUTLIER -42.73 -32.4 0.59 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.782 0.325 . . . . 0.0 111.44 -179.884 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -108.76 -14.65 14.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.342 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.531 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 2.9 m120 -104.98 32.96 3.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.193 0.521 . . . . 0.0 110.231 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.402 ' HB3' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -125.23 -44.55 1.88 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.365 -178.759 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.449 ' C ' ' H ' ' A' ' 27' ' ' THR . 3.5 p90 -88.19 -34.17 17.9 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.135 -178.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.531 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER -55.26 -8.94 0.36 Allowed 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.233 -179.861 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.454 ' CG2' HD23 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -91.52 11.34 24.4 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.179 179.839 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.72 -42.35 0.07 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.212 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.84 -55.43 4.99 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.452 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.408 ' HD2' ' HB2' ' A' ' 26' ' ' LEU . 0.7 OUTLIER -89.07 -20.63 24.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.725 179.6 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.44 -43.64 93.09 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.645 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -64.69 -29.01 70.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.944 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.456 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.21 -40.02 38.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.777 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.626 ' HB3' ' CH2' ' A' ' 48' ' ' TRP . 10.8 mt -70.37 -59.04 3.1 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.551 ' HA ' HD22 ' A' ' 40' ' ' LEU . 2.2 t -39.51 -33.15 0.15 Allowed 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.38 178.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.82 -38.23 46.8 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.517 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 34' ' ' LEU . 5.4 mt-10 -88.88 -18.8 26.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.51 -179.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.581 ' HG ' ' CE2' ' A' ' 48' ' ' TRP . 4.2 mm? -89.11 -1.06 57.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.63 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 48.93 69.3 1.03 Allowed Glycine 0 C--N 1.335 0.487 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.876 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.62 ' HB2' ' HB2' ' A' ' 44' ' ' GLN . 1.8 pt? -154.22 -150.85 0.34 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.357 0.598 . . . . 0.0 111.676 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -136.1 -89.71 0.3 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.692 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.438 ' HA ' HG13 ' A' ' 45' ' ' ILE . 2.5 tt0 -137.08 -46.9 0.58 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.798 0.332 . . . . 0.0 111.541 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.23 -19.61 66.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.685 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.73 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -95.36 -18.57 20.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.984 0.421 . . . . 0.0 110.105 179.775 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.764 HD12 ' CH2' ' A' ' 48' ' ' TRP . 7.7 mm -54.71 -47.47 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.447 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -68.39 -10.59 56.14 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.789 178.172 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.73 ' HB ' ' O ' ' A' ' 44' ' ' GLN . 1.1 mp -73.57 -32.34 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.381 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.764 ' CH2' HD12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -71.44 -54.45 10.61 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.557 179.513 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.604 ' CZ ' ' CE3' ' A' ' 48' ' ' TRP . 1.5 m-85 -64.09 -39.12 93.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.667 -178.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.464 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 3.6 pt20 -58.95 -24.93 63.07 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.316 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -90.66 -30.12 17.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.471 179.308 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -81.71 -24.6 36.07 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.901 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 4.7 tpt85 -79.37 -2.59 42.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.411 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -99.23 24.44 7.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.726 0.298 . . . . 0.0 111.151 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.66 36.09 0.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.962 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -130.32 42.41 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.054 0.454 . . . . 0.0 110.947 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 -165.52 -54.57 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.902 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.95 90.08 0.06 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.893 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.898 179.983 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 N-CA-C 112.538 -0.225 . . . . 0.0 112.538 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -134.24 113.22 11.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.848 0.356 . . . . 0.0 110.828 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 64.05 47.64 3.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.775 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.53 46.82 1.2 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.888 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.5 mtp85 -80.61 132.2 58.9 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.651 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.418 ' HB3' ' CA ' ' A' ' 9' ' ' SER . 88.1 Cg_endo -89.43 -169.23 0.36 Allowed 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 122.771 2.314 . . . . 0.0 112.643 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -114.02 35.61 4.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.265 0.555 . . . . 0.0 110.732 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -163.63 -74.73 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.334 179.58 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 179.3 30.85 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.069 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.626 ' CG ' ' HB3' ' A' ' 13' ' ' LEU . 0.4 OUTLIER 173.37 116.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.197 179.781 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.461 ' O ' ' CB ' ' A' ' 10' ' ' SER . 1.3 p -80.38 38.07 0.41 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.217 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.479 ' HA ' ' CD2' ' A' ' 13' ' ' LEU . 4.9 t 83.72 -21.97 0.25 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.889 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -102.7 11.82 37.15 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.273 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.491 ' CG ' ' HB3' ' A' ' 8' ' ' PHE . 0.4 OUTLIER -122.86 -21.42 5.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.687 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.626 ' HB3' ' CG ' ' A' ' 8' ' ' PHE . 0.5 OUTLIER -105.54 -10.61 16.77 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.021 0.439 . . . . 0.0 110.699 178.947 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.57 ' N ' HD23 ' A' ' 13' ' ' LEU . . . -77.92 -26.31 48.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.806 179.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.4 mtm180 -62.35 -36.88 83.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.717 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.63 -20.87 51.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.922 179.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.627 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -105.23 -47.25 4.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.049 179.533 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.405 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 12.3 ttm180 -59.64 -30.28 68.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.542 179.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.5 -48.46 77.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.779 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.627 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.9 p90 -86.18 -23.89 26.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.861 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.405 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 0.9 OUTLIER -54.28 -25.46 23.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.984 0.421 . . . . 0.0 109.962 178.903 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.442 ' O ' HD23 ' A' ' 26' ' ' LEU . 30.2 mt-10 -97.04 16.33 19.91 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.757 179.207 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.559 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.7 OUTLIER -159.86 37.49 0.18 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.463 179.649 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -133.69 -32.72 1.11 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.664 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.518 ' CE1' HD22 ' A' ' 26' ' ' LEU . 16.7 p90 -105.09 -45.38 4.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.255 -0.429 . . . . 0.0 112.151 -178.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.518 HD22 ' CE1' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -46.34 -35.23 5.2 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.656 0.741 . . . . 0.0 109.939 -179.696 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.429 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -51.52 -25.78 7.29 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.11 178.629 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -136.05 24.61 3.3 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.326 179.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.22 -52.03 0.96 Allowed 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.992 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.477 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -133.06 18.24 4.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.342 179.963 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 26' ' ' LEU . 44.0 ttp85 -67.38 -41.67 84.64 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.188 0.518 . . . . 0.0 109.8 179.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -43.0 91.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.226 179.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.53 -32.51 68.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.181 0.515 . . . . 0.0 109.912 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.661 HD21 ' CZ2' ' A' ' 48' ' ' TRP . 5.8 mt -67.39 -57.85 5.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.338 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.4 t -51.25 -25.88 6.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.168 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.0 m -91.46 -20.34 21.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.416 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -114.34 27.77 9.24 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.812 0.339 . . . . 0.0 111.024 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.458 ' HB3' ' CD1' ' A' ' 40' ' ' LEU . 0.8 OUTLIER -134.27 -59.57 0.82 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.122 0.487 . . . . 0.0 110.633 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 128.22 -6.96 6.76 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.754 -179.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.458 ' CD1' ' HB3' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -91.27 -158.66 0.57 Allowed 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.288 0.566 . . . . 0.0 111.065 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -118.93 -71.67 0.73 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.262 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -169.68 -44.31 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.456 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -64.41 -18.58 64.84 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.999 178.447 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.416 ' HB2' ' HB3' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -98.82 -17.71 18.31 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.817 178.916 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.917 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 3.5 mm -62.22 -59.29 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.567 178.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.492 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 6.6 pttt -56.68 -18.74 13.32 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.22 178.382 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.456 ' CD1' ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -79.09 -48.84 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 -178.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.917 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 44.1 p-90 -64.39 -25.38 67.99 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 119.373 -0.931 . . . . 0.0 112.323 -177.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.703 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 27.0 m-85 -66.94 -52.8 38.59 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 177.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -56.23 -27.3 54.44 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.997 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -85.04 -31.25 23.53 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.842 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.07 -30.39 70.9 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.635 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -76.38 -30.01 57.38 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.83 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -101.42 25.78 7.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.119 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -123.18 29.86 6.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.891 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.3 tt -173.1 42.57 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.128 0.49 . . . . 0.0 110.903 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 34.0 ttt-85 -132.16 -46.14 0.92 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.861 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.19 -36.61 78.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.814 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.819 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 112.471 -0.251 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -111.03 -25.53 9.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.718 0.294 . . . . 0.0 111.142 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 65.83 48.24 1.9 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.896 0.379 . . . . 0.0 110.851 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.457 ' O ' ' CG ' ' A' ' 3' ' ' ARG . 1.5 mtpp -162.99 60.76 0.19 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.476 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.457 ' CG ' ' O ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER 58.18 138.24 0.03 OUTLIER Pre-proline 0 CA--C 1.532 0.263 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.399 -179.704 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -87.5 -166.83 0.3 Allowed 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.678 2.252 . . . . 0.0 112.632 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.13 52.58 1.2 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.207 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.01 -77.4 0.41 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.004 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.4 -33.58 76.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.624 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.496 ' HB2' ' CD2' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -177.41 107.72 0.06 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.138 0.494 . . . . 0.0 111.671 179.718 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.538 ' O ' ' CB ' ' A' ' 10' ' ' SER . 0.2 OUTLIER -101.31 40.3 1.31 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.335 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 9' ' ' SER . 4.7 m 96.64 -30.14 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.008 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -77.02 -18.95 57.8 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.761 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -98.16 1.4 47.43 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.883 0.373 . . . . 0.0 111.413 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.619 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -119.79 -29.93 4.89 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.292 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.74 -26.46 54.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.063 178.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.41 -27.71 12.65 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.819 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -86.35 -10.21 54.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.589 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.577 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 31.3 ttmt -110.59 -35.41 6.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.988 0.423 . . . . 0.0 110.185 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.43 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 0.0 OUTLIER -75.11 -31.7 61.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.63 179.538 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.23 -43.22 99.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.112 -179.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.577 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.4 p90 -91.85 -22.5 20.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.203 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.43 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 1.3 m-80 -53.08 -29.22 29.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.064 0.459 . . . . 0.0 109.913 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -86.84 -13.28 45.42 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.721 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.695 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.7 OUTLIER -127.81 41.16 3.56 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.604 0.716 . . . . 0.0 110.361 179.181 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.419 ' HG3' ' N ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -99.5 -43.25 6.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.422 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.52 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 12.4 p90 -79.75 -44.25 21.07 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.656 -1.157 . . . . 0.0 111.79 -179.042 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.695 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.5 OUTLIER -50.05 -27.62 5.86 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.342 0.592 . . . . 0.0 110.319 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.46 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 2.3 p -61.37 -20.24 62.79 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.725 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -136.37 12.35 3.26 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.521 179.05 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.84 -29.97 4.21 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.042 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.423 ' HG3' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -146.64 20.25 1.32 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.784 179.886 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.46 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 2.3 ttt180 -88.57 -44.0 10.97 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 121.044 0.449 . . . . 0.0 109.813 179.35 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -59.75 -28.85 67.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.817 -0.628 . . . . 0.0 109.799 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.514 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -67.73 -34.87 77.69 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.271 179.421 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.701 ' HB3' ' CH2' ' A' ' 48' ' ' TRP . 0.9 OUTLIER -71.97 -61.41 1.8 Allowed 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.431 179.295 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.414 ' HB2' HD12 ' A' ' 45' ' ' ILE . 10.7 t -44.72 -29.5 0.78 Allowed 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.878 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.52 -26.43 18.78 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.179 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 34' ' ' LEU . 4.3 tt0 -106.04 20.11 19.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.786 0.327 . . . . 0.0 110.88 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.447 ' CB ' ' CD1' ' A' ' 40' ' ' LEU . 2.7 mm? -118.72 -43.43 2.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.39 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 99.31 34.87 4.92 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.669 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.494 HD22 ' CD1' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -123.93 -159.6 0.87 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.23 0.538 . . . . 0.0 111.646 -179.378 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.51 -84.82 0.65 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.794 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -147.07 -46.9 0.18 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.859 0.361 . . . . 0.0 110.681 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.446 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -67.6 -11.68 58.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.265 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.48 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -97.65 -19.89 17.98 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.004 0.43 . . . . 0.0 109.969 179.222 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.613 ' HA ' ' CE2' ' A' ' 48' ' ' TRP . 44.8 mm -56.69 -61.39 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.668 178.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -59.58 -14.76 14.59 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.822 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.49 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 1.3 mp -77.73 -37.58 24.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -178.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.789 ' CZ3' ' CZ ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -76.52 -33.41 58.6 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 118.505 -1.278 . . . . 0.0 111.975 -179.154 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.789 ' CZ ' ' CZ3' ' A' ' 48' ' ' TRP . 5.4 m-85 -66.94 -42.68 84.88 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 119.675 -0.81 . . . . 0.0 109.09 178.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.49 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 6.3 pt20 -62.84 -31.27 72.25 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -80.43 -31.71 37.47 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.642 178.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.5 mtmm -62.28 -29.36 70.37 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.453 179.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.31 26.6 7.57 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.829 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -97.69 23.42 7.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.186 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -159.01 29.61 0.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.772 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -164.45 42.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.211 0.529 . . . . 0.0 110.865 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.79 -46.82 0.11 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.787 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -59.34 -38.36 80.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.901 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.9 m . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.922 179.928 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 N-CA-C 112.479 -0.248 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -83.09 172.29 12.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.859 0.361 . . . . 0.0 110.882 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 63.52 47.4 3.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.814 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.6 mtpt -141.17 48.42 1.68 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.96 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 20.4 mtt180 -137.2 139.36 27.87 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.981 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.424 ' HB3' ' N ' ' A' ' 9' ' ' SER . 51.5 Cg_exo -56.11 -161.36 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.616 2.211 . . . . 0.0 112.404 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -112.3 30.38 7.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.088 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -176.95 -71.03 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.054 179.562 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.406 ' O ' ' CB ' ' A' ' 8' ' ' PHE . . . -173.11 33.27 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.269 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.519 ' CD1' ' N ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER 158.25 122.72 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.995 -1.002 . . . . 0.0 108.902 -179.577 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.424 ' N ' ' HB3' ' A' ' 4' ' ' PRO . 3.9 p -66.72 158.1 31.05 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.383 -179.459 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.461 ' HA ' ' CD2' ' A' ' 13' ' ' LEU . 37.0 m -47.89 -31.23 4.88 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.209 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -53.76 -30.85 46.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.805 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.452 ' CB ' ' HB2' ' A' ' 8' ' ' PHE . 5.9 mm-40 -83.38 -45.06 14.15 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.13 179.08 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.473 HD11 ' CD2' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -64.72 -30.31 71.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.741 179.082 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.76 -18.1 45.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.737 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -52.46 36.47 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.577 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.26 -33.65 72.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.052 0.453 . . . . 0.0 110.582 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.621 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.9 OUTLIER -66.77 -54.41 23.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.2 179.491 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -61.49 -29.94 70.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.421 179.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.81 -50.62 62.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.875 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.621 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.9 OUTLIER -82.38 -24.55 34.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.888 179.853 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -54.11 -25.97 24.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.118 0.485 . . . . 0.0 109.831 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.508 ' O ' HD21 ' A' ' 26' ' ' LEU . 0.2 OUTLIER -97.52 19.28 13.67 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.662 179.201 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.555 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.7 OUTLIER -163.02 37.38 0.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.145 0.497 . . . . 0.0 110.762 179.618 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.14 -38.34 1.23 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.12 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.528 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 19.6 p90 -94.27 -44.98 7.7 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.596 -178.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.571 ' O ' ' N ' ' A' ' 31' ' ' ARG . 0.3 OUTLIER -49.29 -29.64 6.25 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.358 0.599 . . . . 0.0 110.102 -179.564 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.2 p -57.79 -22.04 45.06 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.114 178.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -133.42 10.18 4.06 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.611 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -123.79 -40.65 2.3 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-O 120.969 0.414 . . . . 0.0 110.921 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.57 -12.51 10.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.085 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.571 ' N ' ' O ' ' A' ' 26' ' ' LEU . 3.6 ttt180 -56.96 -23.74 47.91 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.848 0.356 . . . . 0.0 110.81 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.01 -19.37 40.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.281 179.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.51 -46.24 11.04 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.27 179.488 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.559 ' O ' ' N ' ' A' ' 37' ' ' GLU . 0.2 OUTLIER -63.51 -59.14 5.03 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.914 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.5 t -39.38 -32.76 0.13 Allowed 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.356 179.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.5 -27.82 41.44 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.194 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 34' ' ' LEU . 0.6 OUTLIER -73.39 -60.84 2.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.889 179.899 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.575 HD21 HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -56.29 -53.44 57.21 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.099 0.476 . . . . 0.0 110.41 179.846 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 114.12 43.15 0.8 Allowed Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.723 -179.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.575 HD11 HD21 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -129.63 -160.93 1.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.992 0.425 . . . . 0.0 111.398 -179.383 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.43 ' OD1' ' N ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -119.46 -91.58 0.55 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.16 -179.299 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.403 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 1.2 mp0 -136.77 -45.7 0.59 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.765 0.317 . . . . 0.0 111.333 -179.165 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.43 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -66.36 -11.76 52.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.265 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.492 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 0.4 OUTLIER -103.39 -21.33 13.82 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.464 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.756 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 42.5 mm -57.41 -61.14 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.492 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.453 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 9.4 ttmt -57.56 -17.0 11.73 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.757 178.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.43 ' CD1' ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -77.3 -34.83 21.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 -178.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.756 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -79.83 -32.4 40.62 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 118.685 -1.206 . . . . 0.0 111.611 -179.488 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.721 ' CE1' ' CZ3' ' A' ' 48' ' ' TRP . 3.7 m-85 -65.71 -41.49 92.24 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 119.655 -0.818 . . . . 0.0 109.179 178.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.425 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 5.1 pt20 -61.36 -26.33 67.75 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 121.075 0.464 . . . . 0.0 109.805 179.25 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -88.89 -30.66 18.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.924 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.4 -27.88 61.7 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.634 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.16 37.96 2.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.813 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.3 -37.71 78.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.173 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.17 31.11 19.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -135.55 42.87 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.204 0.526 . . . . 0.0 110.99 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.6 mmt180 -129.74 -35.21 1.69 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.745 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.17 52.74 2.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.968 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.973 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.16 0 N-CA-C 112.514 -0.234 . . . . 0.0 112.514 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -168.46 -174.39 2.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.786 0.327 . . . . 0.0 110.915 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 64.3 47.68 3.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.866 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -146.91 47.5 1.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.915 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 51.6 mtt85 -135.66 152.66 76.57 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.827 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.11 160.11 46.18 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.532 2.155 . . . . 0.0 112.193 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 62.3 mtt85 56.26 42.51 27.85 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.483 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -177.9 -70.37 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.349 -179.587 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -83.57 -27.18 29.45 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.703 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.52 ' O ' ' CD1' ' A' ' 8' ' ' PHE . 0.1 OUTLIER -174.86 105.34 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.035 179.683 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.557 ' O ' ' CB ' ' A' ' 10' ' ' SER . 0.7 OUTLIER -100.11 42.78 1.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.031 -179.045 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' A' ' 9' ' ' SER . 5.1 t 93.37 -26.03 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.797 179.115 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -91.05 9.8 29.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.927 -178.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.518 ' HG2' ' HB3' ' A' ' 8' ' ' PHE . 10.4 tp60 -126.55 -9.26 6.24 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.893 0.378 . . . . 0.0 110.835 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.568 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -115.11 -24.45 8.53 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.293 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.9 -20.85 62.68 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.946 178.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -69.21 -29.68 67.69 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.562 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.29 -34.0 74.49 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.942 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.624 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 18.9 mttt -58.08 -42.92 86.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.595 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 1.5 ttm-85 -78.26 -32.5 49.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.354 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.39 -42.73 74.74 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.287 -179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.624 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.4 OUTLIER -86.42 -22.05 26.78 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.22 -179.642 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -48.09 -53.32 16.92 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.834 0.35 . . . . 0.0 110.818 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -78.7 -13.51 59.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.048 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.54 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER -103.19 32.47 3.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.248 0.547 . . . . 0.0 109.803 179.701 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.45 -38.12 2.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.745 -178.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.455 ' C ' ' H ' ' A' ' 27' ' ' THR . 8.8 p90 -92.68 -36.99 12.64 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.397 -178.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.54 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -53.94 -9.98 0.29 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.331 -179.944 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.501 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.5 OUTLIER -83.16 -22.69 33.2 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.649 179.617 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -133.09 16.04 4.18 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.069 178.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.0 tpt180 -121.26 -55.97 1.93 Allowed 'General case' 0 C--O 1.231 0.099 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.503 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.415 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -120.07 4.1 10.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.135 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.501 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.3 OUTLIER -56.86 -28.37 61.65 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 121.009 0.433 . . . . 0.0 110.318 179.454 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -79.13 -20.41 48.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.171 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.23 -44.99 11.04 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.663 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.573 HD23 ' CZ2' ' A' ' 48' ' ' TRP . 0.6 OUTLIER -57.77 -45.82 85.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.787 179.107 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.8 t -48.01 -26.64 1.86 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.093 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.47 -10.58 21.99 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.509 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -76.3 -61.83 1.82 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.745 0.307 . . . . 0.0 111.062 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.558 HD21 ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -71.36 -47.27 57.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.117 0.484 . . . . 0.0 110.239 179.66 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 123.35 4.47 8.3 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.465 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.454 HD21 ' CD1' ' A' ' 48' ' ' TRP . 0.3 OUTLIER -106.71 -167.99 1.36 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.955 0.407 . . . . 0.0 111.208 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.586 ' O ' HG12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -113.8 171.62 7.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.894 -179.888 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.446 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 49.5 mt-10 -52.78 -39.0 61.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.575 -179.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.72 -23.5 42.86 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.316 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.541 ' HA ' ' HB ' ' A' ' 47' ' ' ILE . 0.8 OUTLIER -107.66 -21.77 12.75 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.666 179.687 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.92 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 10.8 mm -57.32 -57.79 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.28 179.148 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.432 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -59.84 -20.05 54.65 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.151 178.093 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.541 ' HB ' ' HA ' ' A' ' 44' ' ' GLN . 1.4 mp -79.2 -46.73 23.22 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -178.375 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.92 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 25.2 p-90 -66.54 -30.17 70.42 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 119.003 -1.079 . . . . 0.0 111.958 -177.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.649 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 21.5 m-85 -64.17 -53.52 48.09 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 177.083 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 10.4 pt20 -56.72 -25.65 55.0 Favored 'General case' 0 N--CA 1.457 -0.087 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.109 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.2 m-20 -86.09 -30.77 22.32 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.216 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.13 -9.28 59.83 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.095 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.32 48.02 1.67 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.0 0.428 . . . . 0.0 110.816 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.403 ' CB ' ' O ' ' A' ' 50' ' ' GLN . . . -119.82 -64.41 1.27 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.171 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.01 33.25 17.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.585 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 30.7 mt -155.57 60.54 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.528 0.68 . . . . 0.0 110.72 179.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.9 mtt180 -145.98 -46.85 0.2 Allowed 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.77 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.5 mpt_? -54.76 -30.91 57.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.968 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.895 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -96.96 40.44 1.14 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.832 0.349 . . . . 0.0 110.919 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 61.87 46.11 7.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.772 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.26 46.03 1.42 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.742 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.0 mtt180 179.57 162.16 0.8 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.636 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -76.62 -165.44 0.32 Allowed 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.473 2.116 . . . . 0.0 112.167 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -106.85 31.82 5.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.267 0.556 . . . . 0.0 111.196 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -178.46 -69.59 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.801 179.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -159.52 -42.89 0.05 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.954 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.567 ' CG ' ' O ' ' A' ' 8' ' ' PHE . 1.2 p90 -150.78 96.33 2.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.729 178.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.442 ' O ' ' CB ' ' A' ' 10' ' ' SER . 37.6 m -133.33 23.41 4.09 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.635 -0.426 . . . . 0.0 112.097 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.442 ' CB ' ' O ' ' A' ' 9' ' ' SER . 0.7 OUTLIER 164.67 -59.65 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 178.351 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -69.2 -22.84 63.87 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -178.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.42 ' CB ' ' HB2' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -100.2 -8.36 23.65 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.782 0.325 . . . . 0.0 111.14 -179.848 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.663 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -115.39 -2.8 12.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.037 179.31 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -106.64 -28.52 10.17 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.8 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.424 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 5.9 mtp180 -112.82 -16.45 12.73 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.71 -179.6 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -95.61 22.48 7.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.804 0.335 . . . . 0.0 111.183 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.44 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -165.15 21.29 0.05 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.367 -179.707 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.514 ' HA ' ' ND2' ' A' ' 21' ' ' ASN . 0.0 OUTLIER -165.26 -51.35 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.737 0.303 . . . . 0.0 111.252 -179.895 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 15' ' ' ARG . 2.4 mm-40 -71.32 -25.34 62.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.204 -179.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.52 ' CD1' ' C ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -76.65 -28.06 55.87 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.063 -179.914 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.514 ' ND2' ' HA ' ' A' ' 18' ' ' ARG . 3.7 p30 -78.86 7.79 6.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.773 0.32 . . . . 0.0 111.165 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.446 ' HA ' ' CE1' ' A' ' 25' ' ' TYR . 30.2 mm-40 -128.76 5.64 5.53 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.413 179.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.476 ' CG ' ' O ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -152.48 13.09 0.55 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.039 -179.13 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.472 ' O ' ' CG2' ' A' ' 27' ' ' THR . 0.0 OUTLIER -138.22 -59.29 0.64 Allowed 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.354 0.597 . . . . 0.0 110.575 179.792 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.501 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 1.6 p90 -45.6 -29.87 1.33 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.013 179.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.501 ' N ' ' CD1' ' A' ' 25' ' ' TYR . 2.6 pt? -57.26 -10.8 1.41 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.76 -178.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.529 ' HA ' ' HB3' ' A' ' 31' ' ' ARG . 1.3 p -93.51 -5.77 48.32 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.301 0.572 . . . . 0.0 109.63 179.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -148.51 22.35 1.03 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.015 179.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.406 ' N ' ' O ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -151.59 -39.09 0.12 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.214 -179.524 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.41 ' CG ' ' O ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -128.9 32.2 4.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.024 179.645 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.529 ' HB3' ' HA ' ' A' ' 27' ' ' THR . 0.0 OUTLIER -96.58 -25.38 15.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.759 -179.7 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -99.62 -8.22 24.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.131 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.99 -38.68 8.49 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 178.663 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.543 HD21 ' CZ2' ' A' ' 48' ' ' TRP . 3.6 tt -68.01 -52.72 32.42 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.271 -1.331 . . . . 0.0 109.254 178.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.507 ' HA ' HD11 ' A' ' 45' ' ' ILE . 10.7 t -58.75 -20.71 51.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.443 179.066 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 75.2 m -91.1 -16.84 27.16 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.453 ' HG3' ' HG ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -100.82 23.56 10.42 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.381 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.589 ' HB2' HD13 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -166.94 16.39 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.617 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 45.59 32.89 4.33 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.025 -0.607 . . . . 0.0 113.351 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.589 HD13 ' HB2' ' A' ' 38' ' ' LEU . 11.6 mt -99.87 142.94 30.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.86 0.362 . . . . 0.0 110.43 179.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.475 ' O ' HG12 ' A' ' 45' ' ' ILE . 0.7 OUTLIER -68.41 141.14 55.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.247 -179.541 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.99 -33.76 18.89 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 121.184 0.516 . . . . 0.0 110.428 179.789 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.46 -33.01 37.03 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.778 0.799 . . . . 0.0 109.739 178.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.422 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -77.44 -16.38 58.82 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.457 -179.635 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.553 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 16.7 mm -62.43 -49.28 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.003 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 22.3 mtmt -70.86 -4.39 24.05 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.946 178.209 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.479 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 1.5 mp -86.45 -32.92 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -178.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.553 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -78.81 -44.99 21.89 Favored 'General case' 0 N--CA 1.461 0.078 0 C-N-CA 118.113 -1.435 . . . . 0.0 111.141 179.689 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.548 ' CE1' ' CZ3' ' A' ' 48' ' ' TRP . 6.0 m-85 -55.52 -43.86 76.13 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 120.104 -0.638 . . . . 0.0 109.625 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.479 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 4.6 pt20 -61.47 -24.77 66.8 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.177 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -90.25 -30.94 17.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.355 179.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.76 -29.04 44.89 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.695 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.41 25.95 7.76 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.849 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -93.54 -21.83 19.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.332 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 66.88 48.08 1.37 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.94 0.4 . . . . 0.0 110.843 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.1 tt -128.19 42.15 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.999 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -145.12 -68.7 0.3 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.769 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 40.7 46.0 2.16 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.648 179.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 26.3 p . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.875 -179.976 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 112.539 -0.224 . . . . 0.0 112.539 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -175.39 139.16 0.43 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.821 0.343 . . . . 0.0 110.921 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -177.02 43.0 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.901 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.21 45.79 8.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.844 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.93 133.84 21.52 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.898 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -84.92 -168.08 0.48 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.658 2.239 . . . . 0.0 112.408 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 18.2 mtt85 -141.51 47.01 1.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.779 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.518 ' CG2' ' N ' ' A' ' 7' ' ' ALA . 3.3 t -144.81 -51.33 0.28 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.832 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.518 ' N ' ' CG2' ' A' ' 6' ' ' THR . . . -64.02 -27.96 69.47 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.503 ' HB2' ' CD2' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -178.8 107.73 0.04 OUTLIER 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.942 179.039 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.546 ' O ' ' CB ' ' A' ' 10' ' ' SER . 92.2 p -102.77 42.47 1.15 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.519 -179.6 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' A' ' 9' ' ' SER . 5.1 m 97.19 -30.23 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.074 179.615 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -76.68 -20.71 56.31 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.875 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.05 1.58 47.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.834 0.35 . . . . 0.0 111.426 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.625 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -120.56 -29.22 4.78 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.191 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.26 -29.47 53.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.077 178.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.65 -25.08 16.9 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.736 179.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -87.05 -9.08 56.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.189 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.634 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 33.2 mttm -106.48 -46.07 4.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.057 0.456 . . . . 0.0 110.038 179.548 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.1 ttp180 -61.77 -29.89 70.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.399 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -63.49 -50.02 71.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.808 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.634 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.4 p90 -83.66 -25.7 30.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.063 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.436 ' O ' ' CD1' ' A' ' 25' ' ' TYR . 1.3 m-80 -52.93 -20.83 3.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.801 0.334 . . . . 0.0 110.317 178.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.57 14.96 25.23 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.55 179.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.549 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -153.76 31.11 0.46 Allowed 'General case' 0 N--CA 1.461 0.124 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.481 ' HG3' ' O ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -146.92 -46.01 0.18 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.761 0.791 . . . . 0.0 109.925 179.521 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.487 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 4.2 p90 -54.78 -38.2 66.97 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.596 -1.184 . . . . 0.0 110.337 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.487 ' N ' ' CG ' ' A' ' 25' ' ' TYR . 1.9 pt? -53.15 -26.77 18.16 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.696 -179.301 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.428 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 6.6 p -67.01 -17.68 65.03 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.418 178.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -135.75 19.07 3.28 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.783 178.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.46 -46.71 1.75 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.664 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.8 11.33 3.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.499 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.475 ' N ' ' O ' ' A' ' 26' ' ' LEU . 1.4 ttm180 -64.66 -34.65 78.79 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.124 0.488 . . . . 0.0 110.111 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -76.91 -10.2 59.21 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.962 179.052 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.85 -15.24 16.28 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.817 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.599 ' O ' HD12 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -102.0 -3.1 28.26 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.47 179.513 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.509 ' HA ' HD11 ' A' ' 45' ' ' ILE . 3.1 t -112.79 -3.18 14.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.637 179.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -116.27 -23.21 8.49 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.237 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.517 ' C ' HD11 ' A' ' 38' ' ' LEU . 0.7 OUTLIER -91.3 15.52 11.86 Favored 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 111.736 0.272 . . . . 0.0 111.736 -179.72 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.599 HD12 ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -158.89 23.11 0.21 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.721 0.296 . . . . 0.0 111.224 -179.08 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 53.2 22.61 14.63 Favored Glycine 0 CA--C 1.518 0.254 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.941 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.543 HD13 ' HB2' ' A' ' 38' ' ' LEU . 6.4 mt -89.75 -171.39 3.16 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.008 0.432 . . . . 0.0 110.828 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.521 ' O ' HG12 ' A' ' 45' ' ' ILE . 1.7 t30 -133.47 140.29 47.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.418 178.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -46.97 -27.97 1.47 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.086 0.47 . . . . 0.0 110.948 -179.553 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.85 -40.42 32.71 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.461 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.49 ' HA ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -84.64 -11.8 55.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.353 -179.473 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.698 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 20.4 mm -55.77 -52.96 42.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.53 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 38.4 mtmt -63.3 -16.26 59.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.248 177.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.49 ' HB ' ' HA ' ' A' ' 44' ' ' GLN . 1.3 mp -79.94 -44.4 22.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -178.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.698 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 13.3 p-90 -71.36 -27.38 63.31 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 118.645 -1.222 . . . . 0.0 111.95 -178.284 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.668 ' CE1' ' CZ3' ' A' ' 48' ' ' TRP . 23.0 m-85 -66.25 -51.07 61.16 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 177.01 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.3 pt20 -58.05 -25.84 61.72 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.021 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -87.24 -30.7 20.74 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.017 179.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.1 mmtp -70.59 -29.19 65.54 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.678 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -118.06 31.61 6.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.847 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -83.06 -46.1 13.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.048 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.95 48.28 3.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.816 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -128.01 42.36 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.934 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -121.01 -34.27 3.56 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.918 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.62 -5.33 47.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.445 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 23.8 p . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.185 -0.912 . . . . 0.0 111.109 -179.984 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.524 -0.231 . . . . 0.0 112.524 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -89.09 -59.53 2.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.796 0.332 . . . . 0.0 110.887 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -176.2 54.58 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.835 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.85 49.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.929 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.2 132.62 21.99 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.919 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -85.85 -175.25 1.8 Allowed 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.721 2.281 . . . . 0.0 112.152 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.404 ' O ' ' HB ' ' A' ' 6' ' ' THR . 31.6 mtt180 -109.04 27.39 9.55 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.417 0.627 . . . . 0.0 111.106 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 5' ' ' ARG . 3.1 t 178.43 -40.59 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.126 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 165.81 -26.25 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.851 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.482 ' CG ' ' O ' ' A' ' 8' ' ' PHE . 0.1 OUTLIER -152.0 92.75 1.76 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.97 179.407 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.551 ' O ' ' CB ' ' A' ' 10' ' ' SER . 1.2 m -88.48 40.35 0.96 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.778 -179.052 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.551 ' CB ' ' O ' ' A' ' 9' ' ' SER . 4.6 t 95.22 -29.73 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.03 179.594 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -75.61 -15.95 60.28 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.531 -179.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.06 -0.35 33.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.891 0.376 . . . . 0.0 111.484 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.61 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -122.41 -31.65 3.75 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.338 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.7 -26.15 63.29 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.198 178.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -76.03 -38.35 57.33 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.48 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -74.18 -39.99 62.83 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.241 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.669 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 14.7 mttm -63.43 -43.91 96.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.211 179.255 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -74.18 -31.44 62.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.156 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -66.15 -46.65 76.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.824 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.669 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.6 OUTLIER -83.25 -25.71 31.4 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.862 179.885 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -51.24 -30.33 17.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.04 0.448 . . . . 0.0 110.344 179.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.598 ' O ' HD21 ' A' ' 26' ' ' LEU . 38.5 mt-10 -118.25 13.66 13.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.613 179.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.576 ' HA ' HD21 ' A' ' 26' ' ' LEU . 9.6 m120 -139.92 50.37 1.74 Allowed 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.314 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.1 ttm180 -138.29 -34.02 0.66 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 -177.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.591 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 13.3 p90 -110.47 -50.25 2.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.724 0.297 . . . . 0.0 111.368 -178.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.598 HD21 ' O ' ' A' ' 22' ' ' GLU . 1.4 pt? -45.64 -34.61 3.55 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.364 0.602 . . . . 0.0 110.005 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.401 ' HB ' ' NH1' ' A' ' 31' ' ' ARG . 1.1 p -52.07 -25.69 9.27 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.884 178.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -132.1 27.94 4.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.878 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.99 -46.28 0.35 Allowed 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.016 -179.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.511 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -113.14 -18.27 12.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.011 -179.627 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.401 ' NH1' ' HB ' ' A' ' 27' ' ' THR . 5.6 ttm180 -50.46 -30.97 13.91 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.049 0.452 . . . . 0.0 110.553 179.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -72.95 -35.12 66.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.192 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.479 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.5 OUTLIER -74.29 -37.63 63.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.021 179.34 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.687 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 5.8 mt -64.22 -50.09 69.39 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.928 179.267 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.7 t -45.69 -28.7 1.06 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.263 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -97.22 -14.1 21.62 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.74 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.426 ' N ' ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -84.66 -66.56 0.88 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.6 0.238 . . . . 0.0 111.258 -179.713 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.444 ' CD2' ' O ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -60.25 -50.12 74.93 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.033 0.444 . . . . 0.0 110.65 -179.919 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 127.5 -1.93 7.04 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.359 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.427 ' CD1' ' CD2' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -96.48 -161.75 0.9 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.913 0.387 . . . . 0.0 110.944 179.867 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -112.26 -100.75 0.41 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.519 -179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -133.21 -47.45 0.84 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.779 0.323 . . . . 0.0 110.916 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.446 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -60.97 -14.79 25.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.894 179.336 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.522 ' H ' ' NE2' ' A' ' 44' ' ' GLN . 0.8 OUTLIER -102.32 -20.65 14.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.266 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.873 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 8.4 mm -60.42 -59.61 3.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.635 178.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.446 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 15.9 mtmt -58.11 -17.82 20.91 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.26 178.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.495 ' O ' ' HG2' ' A' ' 50' ' ' GLN . 1.4 mp -80.26 -43.21 21.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -178.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.873 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 32.4 p-90 -70.72 -26.95 63.63 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 118.904 -1.119 . . . . 0.0 112.197 -177.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.674 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 10.8 m-85 -67.97 -49.33 62.34 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.184 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.495 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.9 pt20 -59.35 -25.67 64.42 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.996 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -89.04 -29.4 19.48 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.946 178.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.409 ' N ' ' O ' ' A' ' 48' ' ' TRP . 36.6 mttt -73.78 -28.84 61.86 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.683 179.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -101.97 26.29 7.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.873 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -84.77 -28.71 26.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.102 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp 62.66 35.03 14.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.827 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -175.95 42.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.123 0.487 . . . . 0.0 110.944 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.77 -68.01 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.814 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.29 84.96 0.11 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.899 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.7 p . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.165 -0.921 . . . . 0.0 110.93 -179.995 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -135.93 -45.94 0.65 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.889 0.376 . . . . 0.0 110.996 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 65.4 47.23 2.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.795 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.9 tttm -176.41 53.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.863 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.428 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -129.12 120.13 20.04 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.958 179.985 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.473 ' HB3' ' N ' ' A' ' 9' ' ' SER . 25.0 Cg_exo -64.26 -161.39 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.698 2.265 . . . . 0.0 112.293 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 8.8 mtt-85 -117.66 31.23 6.83 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.004 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -175.11 -70.92 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.481 179.489 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.486 ' O ' ' HB3' ' A' ' 8' ' ' PHE . . . -173.7 28.99 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.709 179.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.593 ' HB2' ' CD2' ' A' ' 13' ' ' LEU . 0.0 OUTLIER 163.41 115.77 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.781 -179.725 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.473 ' N ' ' HB3' ' A' ' 4' ' ' PRO . 1.0 OUTLIER -87.86 37.91 0.82 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -178.508 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 9' ' ' SER . 3.5 m 85.55 -28.27 0.08 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.911 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -72.23 -33.32 67.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.875 -179.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -4.47 44.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.332 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.593 ' CD2' ' HB2' ' A' ' 8' ' ' PHE . 0.1 OUTLIER -121.0 -15.13 8.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.611 179.705 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -112.23 -21.81 11.25 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.157 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.3 ttm180 -118.47 -55.78 2.19 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.681 0.277 . . . . 0.0 111.207 -179.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.0 -35.13 66.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.885 0.374 . . . . 0.0 110.728 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.541 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.9 OUTLIER -71.06 -57.73 4.25 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.342 179.534 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 20.5 mtm180 -60.48 -30.75 69.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.47 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -61.03 -41.23 96.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.838 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.541 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.5 p90 -98.13 -26.01 14.72 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.884 -0.327 . . . . 0.0 111.431 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -44.08 -58.52 2.79 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.915 0.388 . . . . 0.0 111.11 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -73.63 -18.12 61.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.649 179.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.531 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 1.1 m-80 -106.94 33.46 3.94 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.986 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.95 -33.44 3.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.209 -178.019 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.483 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.2 p90 -100.24 -38.67 8.4 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.524 -178.084 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.531 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.5 OUTLIER -54.1 -9.77 0.29 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.346 -179.77 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.524 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 1.0 OUTLIER -84.8 -16.71 40.54 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.871 179.77 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -138.8 15.07 2.69 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.315 179.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.13 -48.14 2.12 Favored 'General case' 0 CA--C 1.522 -0.103 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.379 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -126.36 2.7 7.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.13 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.524 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.0 OUTLIER -60.41 -21.25 62.01 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 120.98 0.419 . . . . 0.0 110.741 179.391 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -88.34 -32.92 18.17 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 179.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.28 -36.31 79.18 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.851 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.674 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 12.7 mt -67.12 -60.64 2.45 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.837 179.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.2 t -50.48 -24.85 3.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.392 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 98.9 p -92.66 -33.78 14.23 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.676 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.41 24.39 9.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.707 0.289 . . . . 0.0 111.601 -179.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.46 ' CD2' ' CD2' ' A' ' 34' ' ' LEU . 1.8 mm? -128.1 -53.87 1.29 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.265 0.555 . . . . 0.0 110.507 179.599 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.71 -3.46 13.37 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.586 -178.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.45 ' CD1' ' HB3' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -94.92 -160.09 0.76 Allowed 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.399 0.618 . . . . 0.0 111.228 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -117.55 -80.79 0.61 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.902 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -160.04 -43.49 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.444 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -67.53 -12.74 61.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.382 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.537 ' H ' ' NE2' ' A' ' 44' ' ' GLN . 1.3 mp0 -102.19 -18.45 15.51 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.926 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 4.0 mm -62.21 -60.07 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.316 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.524 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -55.52 -19.69 10.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.22 178.332 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.444 ' CD1' ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -77.85 -47.12 25.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -178.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.926 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 46.6 p-90 -67.67 -28.9 68.09 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 119.577 -0.849 . . . . 0.0 112.412 -177.361 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.719 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 17.5 m-85 -62.08 -43.79 98.07 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 177.348 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.407 ' HB2' ' O ' ' A' ' 47' ' ' ILE . 30.0 mt-30 -50.55 -34.08 24.2 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.04 179.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -83.81 -30.31 26.64 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.071 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.52 -27.92 63.53 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.709 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 -64.57 -28.83 69.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.924 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.91 -3.2 43.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.622 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 73.5 mttt 64.2 48.62 2.85 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.917 0.389 . . . . 0.0 110.807 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.8 tt -126.88 41.84 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.183 0.516 . . . . 0.0 110.943 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.7 mtp-105 -157.23 -45.8 0.07 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.794 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -44.53 95.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.852 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.4 t . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.928 179.951 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 N-CA-C 112.618 -0.193 . . . . 0.0 112.618 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -172.31 -176.99 1.71 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.816 0.341 . . . . 0.0 110.889 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -152.24 46.75 0.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.903 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.9 mttp -161.54 50.06 0.22 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.747 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.403 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 34.0 mtp180 63.32 126.05 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.013 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 91.3 Cg_endo -94.75 70.22 0.26 Allowed 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 123.122 2.548 . . . . 0.0 112.646 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.642 ' O ' ' HB ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -163.45 50.18 0.15 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.113 179.96 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.642 ' HB ' ' O ' ' A' ' 5' ' ' ARG . 2.1 m 80.25 -12.45 1.04 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.514 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.634 ' O ' ' CD1' ' A' ' 8' ' ' PHE . . . -68.3 -21.49 64.77 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.006 -0.277 . . . . 0.0 110.948 179.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.634 ' CD1' ' O ' ' A' ' 7' ' ' ALA . 2.1 m-30 148.48 110.99 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.43 0 O-C-N 124.059 0.85 . . . . 0.0 110.939 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.532 ' O ' ' CB ' ' A' ' 10' ' ' SER . 52.8 p -158.77 33.6 0.22 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.752 178.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.532 ' CB ' ' O ' ' A' ' 9' ' ' SER . 3.9 m 94.92 -30.67 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.502 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.02 -45.37 58.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.633 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.418 ' HB3' ' CE1' ' A' ' 8' ' ' PHE . 0.4 OUTLIER -70.8 -28.62 64.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.536 179.609 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.465 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -79.43 -21.33 45.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.379 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -100.85 -27.26 13.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.023 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -88.38 -47.57 8.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.096 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.63 -42.8 93.53 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.715 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.491 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -63.71 -52.46 60.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.029 179.437 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.408 ' O ' ' ND2' ' A' ' 21' ' ' ASN . 7.8 ttm180 -55.19 -28.87 56.11 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.974 179.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -82.58 -48.45 10.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.52 -178.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.511 ' HA ' ' OD1' ' A' ' 23' ' ' ASN . 0.7 OUTLIER -87.18 -29.33 21.84 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.419 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.463 ' HB3' ' O ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -52.66 -26.08 12.73 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.439 179.818 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -88.42 -12.48 43.05 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.81 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.511 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -128.4 38.23 4.01 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.11 0.481 . . . . 0.0 110.659 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.12 -45.78 4.82 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.518 0.675 . . . . 0.0 110.897 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.509 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.8 p90 -76.18 -42.68 45.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.861 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.551 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . 1.3 pt? -52.98 -22.12 5.26 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.101 0.477 . . . . 0.0 110.707 -179.063 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.571 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 2.7 p -64.72 -21.35 66.73 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.551 178.584 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -130.8 11.55 5.19 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.859 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -110.61 -47.57 3.24 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.729 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.551 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -144.62 14.7 1.58 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.741 179.695 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.571 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.1 OUTLIER -75.04 -35.69 61.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.016 0.436 . . . . 0.0 109.924 179.352 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.1 mp0 -61.39 -25.64 67.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.952 179.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.536 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -61.37 -37.33 83.0 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.072 179.446 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.651 ' CB ' ' CZ3' ' A' ' 48' ' ' TRP . 1.0 OUTLIER -73.52 -61.99 1.64 Allowed 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.226 178.705 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.415 ' HB2' HD12 ' A' ' 45' ' ' ILE . 19.7 t -45.65 -27.28 0.76 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.956 178.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.3 t -96.35 -17.47 20.63 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.765 -179.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 34' ' ' LEU . 22.8 mt-10 -121.52 20.52 11.12 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.753 0.311 . . . . 0.0 111.024 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.536 ' HB3' ' CD1' ' A' ' 40' ' ' LEU . 1.6 mm? -110.12 -55.56 2.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.25 0.548 . . . . 0.0 110.364 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 108.77 35.6 2.37 Favored Glycine 0 N--CA 1.448 -0.536 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.125 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.536 ' CD1' ' HB3' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -122.2 -157.11 0.72 Allowed 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.192 0.52 . . . . 0.0 111.143 -179.165 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -126.11 -106.45 0.33 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.737 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -125.78 -40.1 2.08 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.66 1.89 18.43 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.522 ' NE2' ' N ' ' A' ' 44' ' ' GLN . 1.0 OUTLIER -108.42 -21.07 12.9 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.444 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.679 ' HA ' ' CE2' ' A' ' 48' ' ' TRP . 32.7 mm -57.39 -59.05 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.907 0 CA-C-O 121.271 0.558 . . . . 0.0 109.711 178.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt -61.09 -16.33 42.79 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.451 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.492 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 1.3 mp -73.8 -38.68 51.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -178.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.733 ' CZ3' ' CZ ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -69.51 -47.86 62.43 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 118.92 -1.112 . . . . 0.0 111.235 -179.501 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.733 ' CZ ' ' CZ3' ' A' ' 48' ' ' TRP . 2.1 m-85 -63.32 -41.41 98.91 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 121.037 -0.265 . . . . 0.0 111.042 -179.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.492 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 5.0 pt20 -64.04 -26.17 68.44 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.177 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 -90.73 -29.08 17.87 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.345 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.2 mtpp -80.63 -22.64 40.37 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.038 179.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.6 -32.61 11.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.981 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.21 -50.24 23.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.134 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.455 ' O ' ' CG2' ' A' ' 56' ' ' ILE . 1.6 mptt 61.7 38.2 15.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.877 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.455 ' CG2' ' O ' ' A' ' 55' ' ' LYS . 0.6 OUTLIER 46.77 36.18 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 CA-C-O 121.523 0.678 . . . . 0.0 110.815 -179.647 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -147.35 -48.98 0.18 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.926 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 44.32 36.56 1.63 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.413 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.2 m . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.288 -0.863 . . . . 0.0 110.849 179.983 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.214 0 N-CA-C 112.513 -0.235 . . . . 0.0 112.513 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -60.6 117.87 5.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.903 0.383 . . . . 0.0 110.948 -179.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -157.79 52.81 0.46 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.912 179.999 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 44.8 pttt -172.5 48.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.831 179.984 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 59.5 mtt85 -145.48 157.97 51.41 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.881 -179.997 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -68.94 71.3 1.12 Allowed 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.496 2.131 . . . . 0.0 112.294 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.537 ' O ' ' HB ' ' A' ' 6' ' ' THR . 5.3 ttt180 -169.21 56.86 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.722 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.537 ' HB ' ' O ' ' A' ' 5' ' ' ARG . 1.3 m 74.91 -5.44 2.15 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.62 -179.8 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.575 ' O ' ' HB2' ' A' ' 8' ' ' PHE . . . -89.58 25.47 1.99 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.985 0.421 . . . . 0.0 110.295 178.98 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.575 ' HB2' ' O ' ' A' ' 7' ' ' ALA . 69.3 m-85 77.06 111.98 0.07 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.399 179.984 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.528 ' O ' ' CB ' ' A' ' 10' ' ' SER . 29.9 t -165.27 37.77 0.06 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.675 179.256 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.528 ' CB ' ' O ' ' A' ' 9' ' ' SER . 5.8 t 93.97 -29.55 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.487 -179.706 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.04 -59.67 2.64 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.02 179.617 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -61.34 -15.83 39.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.522 177.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.622 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -79.2 -37.12 39.0 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.224 179.462 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.39 -29.05 52.99 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.628 179.47 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.06 -44.74 94.5 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.394 179.719 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.96 -26.13 65.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.483 179.284 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.659 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 4.4 mtmm -68.97 -53.5 20.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.207 179.352 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.5 ttp-105 -61.61 -29.28 69.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.051 179.034 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.89 -50.6 63.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.791 -179.894 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.659 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.2 p90 -82.02 -25.09 34.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.035 179.984 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -53.5 -25.46 16.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.999 0.428 . . . . 0.0 110.124 179.274 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.467 ' O ' HD21 ' A' ' 26' ' ' LEU . 1.7 mm-40 -100.75 17.99 20.56 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.98 179.484 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.54 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.7 OUTLIER -159.32 34.17 0.2 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.024 0.44 . . . . 0.0 110.741 179.35 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.428 ' HD2' ' CE1' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -127.76 -36.34 2.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.198 -179.549 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.595 ' CE1' HD23 ' A' ' 26' ' ' LEU . 25.2 p90 -96.93 -46.41 6.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.748 -178.635 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.595 HD23 ' CE1' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -48.58 -31.27 6.33 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.516 0.674 . . . . 0.0 109.641 179.84 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.532 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 1.4 p -53.65 -24.7 15.08 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.951 178.496 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -133.65 17.69 3.93 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.997 178.769 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.403 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -120.33 -50.0 2.25 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.697 -179.869 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.42 6.59 3.82 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.577 179.99 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.532 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 47.4 ttt180 -75.62 -7.34 54.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.701 0.286 . . . . 0.0 111.182 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -94.66 -23.33 17.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.356 0.598 . . . . 0.0 109.484 178.901 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.82 -42.77 21.09 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.888 179.037 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.503 HD22 ' CH2' ' A' ' 48' ' ' TRP . 0.3 OUTLIER -63.51 -58.91 5.49 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.045 179.064 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.463 ' HA ' HD12 ' A' ' 40' ' ' LEU . 32.8 t -41.74 -32.32 0.38 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.272 179.331 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.5 m -89.71 -33.06 16.74 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.846 179.83 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.403 ' N ' ' O ' ' A' ' 34' ' ' LEU . 36.0 tt0 -67.32 -14.75 63.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.467 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.576 HD11 HD13 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -112.04 -44.93 3.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.776 0.322 . . . . 0.0 110.722 -179.763 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 109.73 46.07 0.93 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.912 179.475 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.576 HD13 HD11 ' A' ' 38' ' ' LEU . 0.4 OUTLIER -144.85 -168.51 2.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.755 0.312 . . . . 0.0 111.011 179.689 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.688 ' O ' HG12 ' A' ' 45' ' ' ILE . 4.9 p30 -129.7 -175.15 3.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.86 -179.722 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.484 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 9.0 mt-10 -49.23 -34.69 15.56 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -177.939 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.19 -23.18 67.31 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -178.814 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.541 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -112.03 -19.13 12.44 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 121.034 -0.266 . . . . 0.0 110.796 -179.272 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.688 HG12 ' O ' ' A' ' 41' ' ' ASN . 38.8 mm -52.12 -60.73 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.845 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 34.6 pttt -59.21 -19.9 49.41 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.661 178.856 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.538 ' HB ' ' HA ' ' A' ' 44' ' ' GLN . 1.7 mp -78.63 -40.78 24.32 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -178.409 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.756 ' CZ3' ' CE1' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -72.84 -31.94 65.11 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 118.513 -1.275 . . . . 0.0 112.296 -178.227 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.756 ' CE1' ' CZ3' ' A' ' 48' ' ' TRP . 9.1 m-85 -66.4 -44.66 82.4 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 119.608 -0.837 . . . . 0.0 109.374 178.474 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.472 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 1.5 pt20 -58.63 -27.23 64.51 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.207 179.751 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -88.89 -30.02 19.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.2 179.138 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.9 mmmt -76.41 -28.92 56.86 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.753 179.637 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.64 30.63 6.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.87 179.902 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.48 -46.58 59.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.141 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.07 -40.81 15.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.882 179.925 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.8 mt 79.95 69.02 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 121.229 0.537 . . . . 0.0 110.824 -179.791 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -138.15 -46.81 0.52 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.872 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.3 -41.55 98.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.85 179.946 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.8 p . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.872 -179.965 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.201 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -97.0 136.69 37.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.842 0.353 . . . . 0.0 110.83 -179.914 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 63.4 47.16 4.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.788 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -149.29 48.75 0.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.896 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -105.96 164.73 14.38 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.983 -179.962 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.405 ' HB3' ' CB ' ' A' ' 9' ' ' SER . 60.1 Cg_endo -72.12 -166.6 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.593 2.195 . . . . 0.0 112.271 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.7 mtt-85 -117.4 31.68 6.59 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.185 0.516 . . . . 0.0 111.514 -179.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.414 ' O ' ' CB ' ' A' ' 7' ' ' ALA . 5.0 t -162.86 -45.53 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.771 179.403 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.414 ' CB ' ' O ' ' A' ' 6' ' ' THR . . . 160.91 -23.36 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.952 -179.689 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.542 ' CD2' HD11 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -161.66 104.59 1.22 Allowed 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.336 179.602 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.492 ' O ' ' CB ' ' A' ' 10' ' ' SER . 3.5 m -81.46 39.4 0.53 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -178.283 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.492 ' CB ' ' O ' ' A' ' 9' ' ' SER . 4.9 t 87.74 -29.51 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.905 179.512 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -64.25 -27.86 69.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.826 179.57 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.445 ' CB ' ' HB3' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -85.44 -44.22 12.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.038 179.333 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.542 HD11 ' CD2' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -59.36 -42.03 90.64 Favored 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.49 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.85 -18.72 61.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.875 179.492 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.8 -50.1 22.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.292 -179.768 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.48 -13.99 25.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.89 -179.723 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.503 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.4 OUTLIER -107.42 -38.85 5.82 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.896 0.379 . . . . 0.0 110.589 179.983 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -79.45 -32.59 42.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.375 -179.829 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -57.9 -39.41 77.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.862 -179.755 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.503 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.5 p90 -94.96 -38.02 10.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.417 -179.9 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.452 ' N ' ' CD1' ' A' ' 20' ' ' PHE . 3.3 m-20 -44.87 -40.12 5.97 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.893 0.378 . . . . 0.0 111.109 -179.698 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -82.03 -24.24 35.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.626 179.66 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.534 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER -110.62 33.69 4.39 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.562 -179.574 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.478 ' HB3' ' O ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -126.79 -35.45 2.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.32 -178.078 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.443 ' C ' ' H ' ' A' ' 27' ' ' THR . 4.7 p90 -101.89 -34.94 9.19 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.379 -178.211 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.534 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -55.11 -10.12 0.49 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.068 179.725 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.459 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -86.73 -16.87 35.11 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.931 179.92 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -140.08 17.74 2.45 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.193 179.218 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -127.41 -53.15 1.37 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.826 -179.559 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.405 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.8 OUTLIER -121.76 3.98 10.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.449 -179.947 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.59 -38.69 69.74 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.069 0.461 . . . . 0.0 110.304 179.669 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -71.88 -46.42 57.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.246 179.253 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.48 -32.85 65.39 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.266 0.555 . . . . 0.0 109.932 179.087 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.627 HD21 ' CZ2' ' A' ' 48' ' ' TRP . 5.0 mt -67.51 -55.95 11.49 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.686 179.845 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.8 t -59.34 -21.12 59.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.035 -179.76 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.0 t -95.26 -14.16 24.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.569 -179.643 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -106.12 -29.05 10.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.01 0.433 . . . . 0.0 110.507 179.843 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.46 ' HB3' ' CD1' ' A' ' 40' ' ' LEU . 4.0 mm? -78.89 -58.55 3.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.749 179.778 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 109.81 15.98 11.34 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.813 -179.114 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.506 HD23 ' NE2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -107.98 -162.64 0.84 Allowed 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.144 0.497 . . . . 0.0 111.361 -179.851 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.428 ' O ' ' N ' ' A' ' 45' ' ' ILE . 0.7 OUTLIER -97.3 146.79 24.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.337 -179.783 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -52.19 -36.7 52.65 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 121.218 0.532 . . . . 0.0 109.904 179.573 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.77 -33.97 60.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.104 178.239 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.541 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -75.82 -13.79 60.29 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.828 179.715 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.868 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 3.0 mm -65.53 -56.91 13.0 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.494 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.51 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.551 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 30.4 mtmt -54.45 -18.82 4.67 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.962 177.71 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.541 ' HB ' ' O ' ' A' ' 44' ' ' GLN . 1.2 mp -76.1 -46.19 34.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -178.851 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.868 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 34.4 p-90 -68.19 -28.21 67.06 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 119.553 -0.859 . . . . 0.0 112.651 -177.453 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.696 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 12.1 m-85 -63.61 -42.54 98.21 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.542 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -56.78 -33.54 66.76 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.679 179.147 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -83.13 -29.81 28.38 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.126 179.204 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.26 -27.17 62.32 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.7 179.622 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.75 26.93 7.44 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.881 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.97 -35.5 80.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.088 179.985 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.5 tttt -78.05 -47.26 18.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.4 mt 79.53 68.77 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.259 0.552 . . . . 0.0 110.868 -179.718 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -164.61 -48.1 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.711 179.914 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.73 43.76 1.19 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.686 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.3 t . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.876 -179.947 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 112.541 -0.224 . . . . 0.0 112.541 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -159.63 77.59 0.69 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.78 0.324 . . . . 0.0 110.891 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -169.95 48.92 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.834 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.8 tmtm? 62.86 46.46 5.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.804 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.21 146.06 0.91 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.794 -179.967 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -81.31 -165.43 0.34 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.682 2.254 . . . . 0.0 112.403 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 26.3 mtt85 -109.48 33.22 4.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.218 0.533 . . . . 0.0 111.081 -179.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.436 ' CG2' ' H ' ' A' ' 7' ' ' ALA . 1.4 t 169.35 -63.94 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.864 179.378 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.436 ' H ' ' CG2' ' A' ' 6' ' ' THR . . . 175.27 45.87 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.057 -179.71 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.492 ' HB3' HD21 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -159.52 98.17 1.38 Allowed 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 114.725 -1.125 . . . . 0.0 111.518 -178.491 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.598 ' O ' ' N ' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -67.3 116.21 7.82 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.878 179.201 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.49 ' HA ' HD22 ' A' ' 13' ' ' LEU . 11.7 t -43.62 -31.4 0.75 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.2 0.524 . . . . 0.0 110.896 179.982 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -75.52 -1.42 24.2 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.069 179.411 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.598 ' N ' ' O ' ' A' ' 9' ' ' SER . 1.0 OUTLIER -112.76 -36.15 5.26 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.583 179.901 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.512 HD23 ' O ' ' A' ' 9' ' ' SER . 0.3 OUTLIER -87.15 -23.04 24.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.552 179.385 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.25 -30.42 70.44 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.545 179.393 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -99.92 -34.22 10.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.664 179.644 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.405 ' O ' ' N ' ' A' ' 20' ' ' PHE . . . -64.58 -33.07 75.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.265 179.435 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.579 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.1 OUTLIER -54.21 -26.98 31.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.33 179.288 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.419 ' HA ' ' ND2' ' A' ' 21' ' ' ASN . 1.0 OUTLIER -89.68 -28.64 19.31 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.754 179.668 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -94.06 -8.96 38.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.496 -179.126 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.579 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -117.38 -24.88 7.21 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -179.442 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.496 ' HB3' ' O ' ' A' ' 17' ' ' LYS . 5.8 p30 -50.26 -40.47 48.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.89 0.376 . . . . 0.0 110.739 179.879 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -81.31 -10.64 59.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.983 179.52 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.533 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER -102.66 32.32 3.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.273 0.559 . . . . 0.0 109.633 179.633 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.85 -42.12 2.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.146 -0.933 . . . . 0.0 111.453 -178.545 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.459 ' C ' ' H ' ' A' ' 27' ' ' THR . 6.9 p90 -88.92 -35.77 16.29 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.279 -178.692 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.533 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER -54.26 -9.02 0.24 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.15 0.5 . . . . 0.0 111.371 -179.891 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.459 ' H ' ' C ' ' A' ' 25' ' ' TYR . 0.5 OUTLIER -88.01 -19.51 27.07 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.927 179.941 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -132.57 12.4 4.48 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.975 178.591 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.22 -44.44 1.14 Allowed 'General case' 0 C--O 1.231 0.098 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.111 179.981 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.433 ' HD3' ' CB ' ' A' ' 26' ' ' LEU . 14.9 mtp180 -110.97 -3.56 15.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.896 179.548 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -11.09 39.38 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.737 0.303 . . . . 0.0 111.066 179.773 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -95.91 -19.78 19.27 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.718 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -86.93 -47.89 8.61 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.994 179.234 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.546 ' HB3' ' CZ3' ' A' ' 48' ' ' TRP . 0.5 OUTLIER -61.66 -48.35 81.22 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.87 179.764 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.511 ' HA ' HD13 ' A' ' 40' ' ' LEU . 6.1 t -50.49 -37.23 37.61 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.892 179.213 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.5 t -98.6 7.7 45.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.472 179.131 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.507 ' C ' HD11 ' A' ' 38' ' ' LEU . 11.5 tt0 -92.88 -38.48 11.7 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.583 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.727 ' CD1' ' N ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -107.82 19.57 19.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.353 -179.406 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 56.25 63.67 5.1 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.478 -0.867 . . . . 0.0 111.455 -179.185 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.511 HD13 ' HA ' ' A' ' 35' ' ' SER . 0.0 OUTLIER -137.93 -160.33 1.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.203 0.525 . . . . 0.0 111.952 -178.428 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.7 -83.89 0.17 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.001 179.97 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.404 ' HA ' HG12 ' A' ' 45' ' ' ILE . 6.0 mp0 -141.45 -39.54 0.39 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.898 0.38 . . . . 0.0 110.633 -179.588 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.434 ' O ' ' CD1' ' A' ' 47' ' ' ILE . . . -66.44 -12.96 59.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.691 -179.953 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.513 ' O ' ' NE1' ' A' ' 48' ' ' TRP . 1.3 mp0 -111.88 -26.26 9.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.804 0.335 . . . . 0.0 110.53 -179.914 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.679 ' HA ' ' CZ2' ' A' ' 48' ' ' TRP . 8.9 mm -60.52 -64.06 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.747 0 CA-C-O 121.352 0.596 . . . . 0.0 110.24 179.574 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -55.72 -21.85 20.76 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.322 179.576 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.474 ' HB ' ' O ' ' A' ' 44' ' ' GLN . 1.2 mp -64.35 -35.96 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.229 -179.642 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.679 ' CZ2' ' HA ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -71.69 -58.61 3.33 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.485 179.686 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.587 ' CZ ' ' CE3' ' A' ' 48' ' ' TRP . 0.4 OUTLIER -60.26 -25.48 65.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.703 -179.563 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -57.08 -29.95 63.91 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.066 0.46 . . . . 0.0 110.03 179.22 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -88.24 -29.06 20.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.326 179.326 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.47 -26.23 41.74 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.879 179.737 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.2 tpt85 -103.78 27.41 7.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.895 179.904 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -121.33 28.66 7.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.138 179.842 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -109.96 -23.2 11.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.047 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -125.55 41.51 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 121.221 0.534 . . . . 0.0 110.875 179.947 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -172.13 -57.46 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.885 179.959 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.2 103.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.771 179.974 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.898 -179.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 112.44 -0.264 . . . . 0.0 112.44 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -72.7 109.91 6.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 0.0 110.891 179.971 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -171.04 63.38 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.875 179.993 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.8 tttm -173.89 64.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.904 -179.892 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.93 145.01 50.48 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.132 179.929 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -81.6 140.63 11.92 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 123.111 2.541 . . . . 0.0 112.79 -179.5 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 61.85 46.69 6.63 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.946 179.662 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -170.59 -72.04 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.662 -179.982 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.424 ' HB2' ' CE1' ' A' ' 8' ' ' PHE . . . -70.22 -42.98 71.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.752 179.683 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.489 ' CD2' ' CD2' ' A' ' 13' ' ' LEU . 0.0 OUTLIER 169.22 113.98 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.558 179.716 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.478 ' O ' ' HB2' ' A' ' 10' ' ' SER . 2.4 p -88.19 38.25 0.85 Allowed 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -179.043 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.478 ' HB2' ' O ' ' A' ' 9' ' ' SER . 15.4 m 87.34 -29.92 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.695 179.624 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.33 -36.15 83.18 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.835 179.751 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.431 ' CB ' ' HB3' ' A' ' 8' ' ' PHE . 0.8 OUTLIER -78.94 -28.33 43.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.979 178.985 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.489 ' CD2' ' CD2' ' A' ' 8' ' ' PHE . 7.6 mt -74.97 -30.77 61.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.344 179.339 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.39 -30.61 30.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.416 -179.812 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.25 -46.55 12.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.182 -179.75 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.01 -44.39 94.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.01 -179.932 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 1.1 ttmm -52.23 -37.36 54.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.493 179.812 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.5 ttm180 -87.98 -31.74 19.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.238 179.32 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.32 -42.7 96.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.197 -179.811 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.7 ' HA ' ' OD1' ' A' ' 23' ' ' ASN . 3.5 p90 -89.52 -22.66 22.32 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.333 -179.739 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.541 ' HA ' ' CD ' ' A' ' 24' ' ' ARG . 0.3 OUTLIER -52.54 -32.84 42.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.048 0.451 . . . . 0.0 110.415 178.051 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -81.2 -9.06 59.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.382 -179.956 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.7 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -125.91 35.39 4.71 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.214 0.531 . . . . 0.0 111.082 179.814 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.541 ' CD ' ' HA ' ' A' ' 21' ' ' ASN . 24.0 mtm105 -100.26 -49.28 4.32 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.754 0.787 . . . . 0.0 110.412 179.853 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.518 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 4.7 p90 -47.75 -39.81 18.9 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.412 -1.267 . . . . 0.0 111.178 -179.876 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.518 ' N ' ' CG ' ' A' ' 25' ' ' TYR . 3.8 pp -51.19 -30.49 17.24 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.862 -179.074 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.58 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 16.5 p -63.13 -19.27 64.3 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.3 -0.863 . . . . 0.0 109.832 179.163 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -131.94 8.05 4.41 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.481 178.748 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -113.27 -43.69 3.33 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.826 179.937 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.435 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -128.32 -1.36 5.67 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.616 179.853 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.58 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.0 OUTLIER -72.9 -11.16 60.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.786 0.327 . . . . 0.0 110.981 179.702 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -102.66 -21.23 14.15 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.004 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -81.97 -41.14 21.2 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.112 179.294 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.622 ' CB ' ' CZ3' ' A' ' 48' ' ' TRP . 10.4 mt -67.79 -59.67 3.13 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.46 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.586 ' HA ' HD23 ' A' ' 40' ' ' LEU . 4.7 t -38.53 -32.94 0.09 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.675 178.756 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.8 t -81.06 -38.32 27.57 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.926 -179.334 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -86.95 -27.24 23.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.814 0.34 . . . . 0.0 111.473 -179.494 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.586 ' HG ' ' CE2' ' A' ' 48' ' ' TRP . 3.5 mm? -78.32 -2.93 40.45 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.643 -179.667 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 50.64 68.63 1.38 Allowed Glycine 0 C--N 1.334 0.469 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.608 179.884 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.637 ' CD1' ' N ' ' A' ' 45' ' ' ILE . 1.9 pt? -153.21 -151.88 0.39 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.285 0.564 . . . . 0.0 111.694 -179.188 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -136.78 -84.12 0.35 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.804 -179.629 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.44 ' HA ' HG13 ' A' ' 45' ' ' ILE . 11.5 tt0 -141.01 -46.77 0.4 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.854 0.359 . . . . 0.0 111.487 -179.297 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.91 -17.43 64.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.716 -179.659 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.728 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -98.56 -18.14 18.31 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.271 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.762 HD11 ' CH2' ' A' ' 48' ' ' TRP . 6.8 mm -55.35 -46.61 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 178.154 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.36 -10.76 59.36 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.869 -1.059 . . . . 0.0 109.755 178.099 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.728 ' HB ' ' O ' ' A' ' 44' ' ' GLN . 1.2 mp -73.08 -33.2 41.85 Favored 'Isoleucine or valine' 0 C--N 1.342 0.277 0 C-N-CA 121.016 -0.274 . . . . 0.0 111.234 -179.926 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.762 ' CH2' HD11 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -70.87 -60.5 2.2 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.322 179.606 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.582 ' CZ ' ' CE3' ' A' ' 48' ' ' TRP . 1.0 OUTLIER -58.84 -30.07 67.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.509 -179.735 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -51.0 -26.85 6.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.103 0.478 . . . . 0.0 109.938 178.961 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -84.7 -31.75 23.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.201 179.106 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.5 ttmm -69.42 -29.44 67.17 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.627 179.593 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -109.07 30.47 6.54 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.794 179.946 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -122.12 30.98 6.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.093 -179.985 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.08 31.69 4.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.89 179.944 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.7 tt -177.02 42.64 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.248 0.547 . . . . 0.0 110.994 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.9 ttt180 -135.81 -38.86 0.71 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.876 -179.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.66 60.33 1.66 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.912 179.992 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.887 -179.915 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.163 0 N-CA-C 112.451 -0.26 . . . . 0.0 112.451 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -110.0 97.4 6.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.809 0.338 . . . . 0.0 110.885 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -163.39 47.73 0.13 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.761 -179.999 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.6 tttt -157.45 47.93 0.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.073 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.3 130.67 5.63 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.94 179.949 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -86.76 -165.37 0.25 Allowed 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.825 2.35 . . . . 0.0 112.437 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.66 44.08 3.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.154 0.502 . . . . 0.0 110.405 179.739 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.88 -78.52 0.59 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.549 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -100.65 24.8 8.55 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.0 0.429 . . . . 0.0 110.391 179.265 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.517 ' CE1' ' HB3' ' A' ' 13' ' ' LEU . 3.8 m-85 -141.16 86.91 2.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.803 -179.63 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.483 ' O ' ' CB ' ' A' ' 10' ' ' SER . 18.9 t -111.94 32.42 5.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.045 0.45 . . . . 0.0 111.458 -179.835 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.483 ' CB ' ' O ' ' A' ' 9' ' ' SER . 3.5 m 88.38 -27.22 0.06 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.342 179.479 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.54 1.8 57.05 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.966 -178.976 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.69 -18.49 10.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.71 0.29 . . . . 0.0 111.187 179.683 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.517 ' HB3' ' CE1' ' A' ' 8' ' ' PHE . 0.6 OUTLIER -104.71 -27.62 11.69 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.922 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.25 -29.22 65.6 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.295 178.975 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -83.95 -43.73 14.92 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.405 179.444 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.24 -29.31 69.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.332 179.285 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.67 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 11.2 ttmt -66.91 -56.5 9.99 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.924 179.367 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.8 ttm-85 -57.44 -29.2 63.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.571 179.196 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -69.68 -49.94 48.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.452 -179.559 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.67 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.6 p90 -85.45 -22.2 28.39 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -179.3 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -52.49 -22.9 5.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.776 0.322 . . . . 0.0 110.429 179.141 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -105.52 12.9 30.83 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.543 -179.889 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.518 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.7 OUTLIER -151.48 35.23 0.56 Allowed 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 179.621 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.511 ' HG3' ' CD1' ' A' ' 20' ' ' PHE . 8.0 mmt180 -148.2 -46.22 0.16 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.774 0.797 . . . . 0.0 109.976 179.556 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.51 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 6.1 p90 -58.02 -39.05 77.39 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.546 -1.206 . . . . 0.0 110.248 179.811 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.56 ' HA ' ' HB3' ' A' ' 29' ' ' ARG . 2.1 pt? -52.67 -30.12 30.22 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.342 -179.564 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.524 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 3.7 p -64.28 -18.33 64.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.661 178.918 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -137.04 19.91 3.0 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.078 178.829 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.56 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.7 OUTLIER -126.1 -41.57 1.92 Allowed 'General case' 0 C--O 1.231 0.11 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.089 -179.454 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.7 19.98 0.91 Allowed 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.766 0.284 . . . . 0.0 111.766 -179.781 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.524 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.6 OUTLIER -81.47 -26.11 35.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.858 0.361 . . . . 0.0 110.474 179.687 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -86.46 -21.65 26.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.173 179.145 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.5 -45.14 12.93 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.082 179.344 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.58 HD21 HD23 ' A' ' 38' ' ' LEU . 0.2 OUTLIER -62.88 -57.65 10.08 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.814 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.9 t -40.53 -32.98 0.23 Allowed 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.186 179.718 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.36 -30.08 47.79 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.856 179.727 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.564 ' N ' ' O ' ' A' ' 34' ' ' LEU . 31.5 mt-10 -71.28 -57.13 4.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.811 179.812 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.601 HD21 HD13 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.39 -47.43 85.47 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.125 0.488 . . . . 0.0 110.34 179.7 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.31 30.9 5.48 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.333 -178.837 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.601 HD13 HD21 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -126.61 -168.29 1.84 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.019 0.437 . . . . 0.0 111.343 -179.48 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.585 ' O ' HG12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -124.09 176.83 6.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.064 179.878 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.417 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 13.6 mp0 -46.85 -30.93 2.74 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.006 -178.675 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.63 -19.85 65.2 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.115 -179.481 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.626 ' NE2' ' N ' ' A' ' 44' ' ' GLN . 0.5 OUTLIER -118.72 -20.9 8.09 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.557 -179.023 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.799 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 46.9 mm -50.81 -58.08 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.473 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.415 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 1.5 mtmt -60.34 -25.08 65.55 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.481 178.391 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.556 ' HB ' ' HA ' ' A' ' 44' ' ' GLN . 1.6 mp -70.93 -39.31 75.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -178.585 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.799 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -74.45 -40.6 61.81 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 118.401 -1.32 . . . . 0.0 111.907 -178.859 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.764 ' CE1' ' CZ3' ' A' ' 48' ' ' TRP . 2.8 m-85 -59.92 -33.74 72.27 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.347 -0.941 . . . . 0.0 108.663 178.025 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.4 ' NE2' ' O ' ' A' ' 46' ' ' LYS . 0.9 OUTLIER -49.32 -27.81 4.26 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.909 179.163 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -88.71 -31.12 18.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.218 179.319 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.8 mmtm -77.82 -27.31 49.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.86 179.707 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.52 -41.63 60.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.783 179.887 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.13 -22.62 59.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.197 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.452 ' O ' ' CG2' ' A' ' 56' ' ' ILE . 11.5 mmtt 61.95 32.76 17.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.844 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.452 ' CG2' ' O ' ' A' ' 55' ' ' LYS . 0.6 OUTLIER 47.07 36.13 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.204 0 CA-C-O 121.491 0.662 . . . . 0.0 110.869 -179.623 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.444 ' O ' ' HG2' ' A' ' 58' ' ' ARG . 25.5 mtt180 -149.65 -46.77 0.13 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.86 -179.996 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.444 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 0.3 OUTLIER 33.8 53.92 0.51 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.908 179.916 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.91 179.913 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.58 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--O 1.23 0.056 0 CA-C-O 121.16 0.505 . . . . 0.0 110.167 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.2 tpp180 -126.17 -35.59 2.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.228 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.493 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 20.5 p90 -100.58 -46.18 5.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.702 -178.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.585 HD23 ' H ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -48.69 -29.84 4.87 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.43 0.633 . . . . 0.0 110.0 -179.939 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.455 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.8 OUTLIER -55.2 -24.71 28.58 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.886 178.617 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.82 8.73 5.32 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.462 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.461 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.9 OUTLIER -112.58 -50.83 2.87 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.828 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.438 ' HD3' ' CB ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -119.93 -7.33 9.96 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.69 -179.797 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.525 ' NE ' HG21 ' A' ' 45' ' ' ILE . 10.2 ttt180 -53.44 -33.59 54.65 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.109 0.48 . . . . 0.0 110.389 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -74.03 -29.69 62.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.508 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.491 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -72.59 -38.95 67.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.461 179.807 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.72 ' HB3' ' CZ3' ' A' ' 48' ' ' TRP . 6.7 mt -70.86 -62.12 1.51 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.9 t -46.48 -29.45 1.76 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.913 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.9 m -73.81 -47.98 34.75 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.163 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.85 -10.7 56.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.024 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.691 ' HG ' ' CZ2' ' A' ' 48' ' ' TRP . 2.2 mm? -89.32 -27.73 20.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.661 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.64 65.51 3.38 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.925 -179.593 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.872 HD22 ' CB ' ' A' ' 44' ' ' GLN . 1.3 pp -157.34 -162.89 1.27 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.978 0.418 . . . . 0.0 111.312 -179.14 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.533 ' O ' HG12 ' A' ' 45' ' ' ILE . 19.4 m-20 -123.07 -177.68 3.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.611 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -58.36 -24.43 59.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.962 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.886 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -72.47 -4.9 33.14 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.872 ' CB ' HD22 ' A' ' 40' ' ' LEU . 16.7 mp0 -120.84 -25.7 5.37 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.951 0.405 . . . . 0.0 109.959 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 1.02 HG22 ' CE2' ' A' ' 49' ' ' PHE . 14.7 mm -57.36 -59.35 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.913 0 CA-C-O 121.661 0.743 . . . . 0.0 109.148 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.498 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 0.2 OUTLIER -55.75 -29.42 59.52 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.528 -1.215 . . . . 0.0 110.144 179.612 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.886 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -59.39 -32.79 49.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.682 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.72 ' CZ3' ' HB3' ' A' ' 34' ' ' LEU . 1.5 m0 -69.97 -63.9 0.99 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.522 0.677 . . . . 0.0 110.112 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 1.02 ' CE2' HG22 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -62.31 -28.22 69.58 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.561 -179.441 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.498 ' CB ' ' O ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -62.96 -32.96 74.4 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 178.86 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.022 178.979 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.77 ' HB2' HD11 ' A' ' 26' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 121.503 0.668 . . . . 0.0 110.616 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.37 -35.51 7.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.572 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.521 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.7 p90 -92.19 -44.34 8.83 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.926 -1.033 . . . . 0.0 111.767 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.77 HD11 ' HB2' ' A' ' 23' ' ' ASN . 0.3 OUTLIER -46.32 -27.33 1.01 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.315 0.579 . . . . 0.0 110.969 -179.13 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.431 HG23 ' H ' ' A' ' 27' ' ' THR . 1.1 p -58.57 -19.73 40.68 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.105 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -123.85 -17.72 6.23 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.438 178.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.441 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 4.6 tmt_? -96.21 -53.08 3.75 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-O 120.948 0.404 . . . . 0.0 110.503 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.525 ' HB2' ' HB2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -82.41 -27.82 31.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.392 179.438 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.555 ' HG3' HG21 ' A' ' 45' ' ' ILE . 27.4 ttt180 -49.77 -29.91 8.59 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 178.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -77.62 -32.48 53.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.383 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.511 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -77.84 -40.43 40.32 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.537 179.621 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.71 HD13 ' CZ3' ' A' ' 48' ' ' TRP . 1.5 mt -63.14 -54.05 43.78 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.082 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.1 t -41.72 -30.8 0.25 Allowed 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.734 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.3 m -120.52 14.97 11.99 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.459 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -105.85 -45.25 4.42 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.782 0.289 . . . . 0.0 111.782 -179.871 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 1.05 HD11 HD21 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -103.34 14.62 31.1 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -179.114 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.11 69.4 1.29 Allowed Glycine 0 CA--C 1.509 -0.343 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.577 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 1.05 HD21 HD11 ' A' ' 38' ' ' LEU . 0.9 OUTLIER -101.25 -164.91 1.15 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.859 0.362 . . . . 0.0 111.873 -179.251 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -126.55 16.55 7.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.038 -178.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.432 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 0.7 OUTLIER 66.9 7.81 5.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.67 0.271 . . . . 0.0 111.28 -179.841 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.783 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -117.62 -29.64 5.7 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.953 0.406 . . . . 0.0 110.533 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.516 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 1.9 mt-30 -88.43 -4.32 58.66 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.787 HG22 ' HE1' ' A' ' 49' ' ' PHE . 9.1 mm -60.41 -58.78 5.8 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.05 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.904 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.483 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 13.8 pttt -62.17 -19.32 62.96 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.909 -1.041 . . . . 0.0 109.631 178.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.783 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.7 mp -67.34 -34.89 71.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.785 ' CH2' HG23 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -69.82 -60.21 2.45 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 119.903 -0.719 . . . . 0.0 110.238 179.832 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.787 ' HE1' HG22 ' A' ' 45' ' ' ILE . 1.4 m-85 -57.73 -29.78 65.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.385 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.483 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -51.79 -29.83 20.64 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.084 0.469 . . . . 0.0 110.074 178.94 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.612 179.652 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.517 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.522 -0.12 0 CA-C-O 121.295 0.569 . . . . 0.0 109.715 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -121.83 -38.75 2.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.821 -178.258 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.45 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 13.0 p90 -89.95 -39.01 13.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.545 -178.509 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.517 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 1.0 OUTLIER -53.05 -14.63 0.64 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 121.107 0.48 . . . . 0.0 111.089 -179.742 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.44 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -77.5 -20.43 54.31 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.811 179.52 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -133.98 14.18 3.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.116 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.435 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -118.53 -42.73 2.74 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.821 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.72 9.61 3.36 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.411 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.612 ' HD3' HG21 ' A' ' 45' ' ' ILE . 1.7 ttm180 -71.59 -46.28 59.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.899 0.38 . . . . 0.0 110.624 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -61.95 -27.89 69.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.887 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.474 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -74.73 -39.46 61.86 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.594 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.686 HD13 ' CZ3' ' A' ' 48' ' ' TRP . 9.8 mt -69.13 -58.49 4.0 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.525 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.847 ' OG ' HD11 ' A' ' 45' ' ' ILE . 1.7 t -40.11 -33.22 0.21 Allowed 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.271 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.4 m -77.24 -39.02 49.92 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.303 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -91.18 -9.21 46.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.629 -179.765 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.718 ' HB3' HD22 ' A' ' 40' ' ' LEU . 4.3 mm? -99.03 2.93 46.68 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.607 0.242 . . . . 0.0 111.451 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 46.84 70.14 0.74 Allowed Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.992 -0.623 . . . . 0.0 113.072 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.765 HD11 HD13 ' A' ' 45' ' ' ILE . 1.8 pt? -156.66 -151.45 0.32 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.295 0.569 . . . . 0.0 111.659 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -136.55 -89.49 0.29 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.098 -0.956 . . . . 0.0 111.615 -179.079 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.46 ' HA ' HG13 ' A' ' 45' ' ' ILE . 14.0 mm-40 -136.97 -46.46 0.58 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.776 0.322 . . . . 0.0 111.605 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.578 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -66.11 -19.15 65.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.751 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.806 ' HA ' HD13 ' A' ' 47' ' ' ILE . 14.8 mp0 -95.61 -17.07 21.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.973 0.416 . . . . 0.0 110.082 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.916 HD13 ' CZ2' ' A' ' 48' ' ' TRP . 8.3 mm -54.66 -49.48 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 178.016 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -66.38 -11.11 49.61 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.913 177.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.806 HD13 ' HA ' ' A' ' 44' ' ' GLN . 1.3 mp -73.67 -33.29 38.05 Favored 'Isoleucine or valine' 0 C--N 1.343 0.29 0 C-N-CA 121.034 -0.266 . . . . 0.0 111.553 -179.665 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.916 ' CZ2' HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -69.11 -60.1 2.58 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.312 179.661 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.793 ' HE2' HG22 ' A' ' 45' ' ' ILE . 1.3 m-85 -57.16 -33.27 67.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.695 -179.282 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.89 -30.15 61.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.08 0.467 . . . . 0.0 109.854 179.046 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.997 179.205 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.444 ' O ' ' CG ' ' A' ' 23' ' ' ASN . 0.2 OUTLIER . . . . . 0 CA--C 1.538 0.515 0 CA-C-O 120.89 0.376 . . . . 0.0 111.294 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.897 ' O ' HG23 ' A' ' 27' ' ' THR . 12.1 mtt180 -133.28 -55.95 0.91 Allowed 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.161 0.505 . . . . 0.0 110.69 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.485 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 1.3 p90 -37.78 -34.37 0.11 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.277 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.685 HD23 ' C ' ' A' ' 24' ' ' ARG . 2.2 pt? -51.58 -28.67 14.69 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.206 -178.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.897 HG23 ' O ' ' A' ' 24' ' ' ARG . 2.5 p -70.83 -14.96 62.6 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.972 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -136.92 15.68 3.07 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.09 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' A' ' 25' ' ' TYR . 16.4 tpt85 -121.62 -48.07 2.18 Favored 'General case' 0 C--O 1.23 0.055 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.579 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.401 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -119.91 -14.28 8.96 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.553 179.965 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.756 ' CG ' HG21 ' A' ' 45' ' ' ILE . 1.7 ttm180 -56.92 -22.49 37.96 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.672 0.273 . . . . 0.0 110.968 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -84.11 -25.17 29.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.048 0.451 . . . . 0.0 109.98 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.91 -44.09 15.77 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.044 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.858 ' O ' HD22 ' A' ' 38' ' ' LEU . 0.2 OUTLIER -64.35 -59.52 4.27 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 178.788 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.6 ' CB ' HD11 ' A' ' 45' ' ' ILE . 30.1 t -39.13 -33.04 0.11 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.374 179.292 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 12.9 m -78.88 -28.35 44.1 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.163 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 34' ' ' LEU . 3.0 tt0 -73.42 -60.63 2.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.877 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 1.091 HD23 HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -56.57 -49.77 73.88 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 121.05 0.453 . . . . 0.0 110.329 179.756 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 108.95 46.26 0.96 Allowed Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.721 -179.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 1.091 HD11 HD23 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -130.17 -160.38 1.03 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.113 0.482 . . . . 0.0 111.413 -179.322 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -118.69 -88.76 0.61 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.675 -0.693 . . . . 0.0 112.068 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.401 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 0.2 OUTLIER -141.04 -46.14 0.39 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.76 0.314 . . . . 0.0 111.1 -179.325 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.949 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -65.98 -12.89 58.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.165 179.726 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.479 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 17.4 mp0 -101.14 -20.27 15.39 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.485 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.885 HG22 ' HE2' ' A' ' 49' ' ' PHE . 41.9 mm -57.58 -60.58 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.501 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -58.02 -16.79 13.9 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.704 178.958 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.949 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -77.37 -36.08 23.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -178.303 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.858 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.8 -31.69 46.07 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 118.653 -1.219 . . . . 0.0 111.777 -179.354 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.885 ' HE2' HG22 ' A' ' 45' ' ' ILE . 4.9 m-85 -65.54 -42.49 91.88 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.064 178.319 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.465 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 6.5 pt20 -61.18 -28.4 69.11 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.741 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 . . . . . 0 N--CA 1.452 -0.326 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.949 178.761 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.83 ' HA ' HD22 ' A' ' 26' ' ' LEU . 0.7 OUTLIER . . . . . 0 CA--C 1.529 0.137 0 CA-C-O 120.851 0.358 . . . . 0.0 111.385 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.432 ' O ' HG23 ' A' ' 27' ' ' THR . 0.0 OUTLIER -124.91 -38.5 2.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.308 0.575 . . . . 0.0 111.0 -179.548 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.476 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 15.9 p90 -83.54 -40.7 18.81 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.0 -179.28 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.83 HD22 ' HA ' ' A' ' 23' ' ' ASN . 2.2 pt? -47.76 -28.22 2.4 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.357 0.598 . . . . 0.0 110.536 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.439 ' H ' HD23 ' A' ' 26' ' ' LEU . 1.2 p -58.2 -23.91 57.29 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.783 178.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -130.31 21.39 5.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.703 178.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.54 -51.24 1.38 Allowed 'General case' 0 C--O 1.231 0.087 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.94 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.515 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -131.26 4.29 4.36 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.855 -179.681 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 26' ' ' LEU . 2.9 ttt180 -58.61 -26.42 63.66 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.871 0.367 . . . . 0.0 110.667 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.94 -21.11 34.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.055 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -87.95 -37.95 15.97 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.635 -0.712 . . . . 0.0 109.52 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.837 HD22 HD21 ' A' ' 38' ' ' LEU . 0.5 OUTLIER -65.37 -49.27 69.95 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.672 178.97 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.79 ' HA ' HD11 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -47.91 -27.09 1.97 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.092 179.266 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.99 -11.9 27.66 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.601 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.403 ' N ' ' O ' ' A' ' 34' ' ' LEU . 9.6 tp10 -76.91 -62.51 1.62 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.638 0.256 . . . . 0.0 110.955 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.934 HD23 ' CD1' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -69.15 -47.63 64.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.187 0.518 . . . . 0.0 110.177 179.528 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 124.68 2.54 8.03 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.501 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.934 ' CD1' HD23 ' A' ' 38' ' ' LEU . 0.2 OUTLIER -102.15 -165.42 1.18 Allowed 'General case' 0 CA--C 1.527 0.093 0 CA-C-O 121.095 0.474 . . . . 0.0 111.396 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.545 ' O ' HG12 ' A' ' 45' ' ' ILE . 17.4 t30 -113.76 166.91 11.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.314 -179.4 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.56 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 91.4 mt-10 -53.07 -28.31 24.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.479 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.792 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -63.82 -48.92 74.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.982 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.509 ' HA ' ' HB ' ' A' ' 47' ' ' ILE . 13.2 mp0 -87.11 -15.09 39.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.225 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.964 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 2.5 mm -59.94 -58.62 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.175 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.538 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 0.2 OUTLIER -57.32 -18.15 15.66 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.1 178.012 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.792 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -79.39 -48.39 21.14 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 -178.603 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.964 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 34.0 p-90 -63.91 -25.84 68.33 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 119.392 -0.923 . . . . 0.0 112.177 -177.327 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.661 ' HE2' HG22 ' A' ' 45' ' ' ILE . 27.5 m-85 -66.33 -53.1 40.17 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 177.407 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.423 ' CG ' ' O ' ' A' ' 47' ' ' ILE . 1.7 pt20 -53.03 -26.49 15.86 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.252 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.024 178.963 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.519 ' HA ' ' CG ' ' A' ' 26' ' ' LEU . 1.7 m-80 . . . . . 0 CA--C 1.519 -0.227 0 CA-C-O 121.514 0.673 . . . . 0.0 109.784 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.6 -20.68 15.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.275 -179.059 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.514 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 12.4 p90 -116.26 -44.6 2.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.487 -178.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.521 ' HB2' ' HB3' ' A' ' 30' ' ' ARG . 0.5 OUTLIER -48.98 -27.11 2.91 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.304 0.574 . . . . 0.0 110.382 -179.811 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.419 HG23 ' H ' ' A' ' 27' ' ' THR . 0.5 OUTLIER -59.53 -24.0 63.32 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.839 178.907 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -130.93 0.29 4.25 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.996 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.85 -29.54 6.35 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.988 0.423 . . . . 0.0 110.997 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.521 ' HB3' ' HB2' ' A' ' 26' ' ' LEU . 6.6 ttm180 -115.89 -24.39 8.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.895 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.627 ' HG3' HG21 ' A' ' 45' ' ' ILE . 32.4 ttp180 -49.47 -31.57 10.25 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.188 0.518 . . . . 0.0 110.161 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -38.29 73.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.973 179.165 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.444 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.02 -37.11 47.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.94 179.219 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.852 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 4.0 mt -67.41 -41.73 84.4 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.519 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.778 ' HA ' HD11 ' A' ' 45' ' ' ILE . 3.4 t -55.66 -26.92 47.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.649 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -112.05 3.13 17.17 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.101 179.569 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.574 ' HB3' HD23 ' A' ' 38' ' ' LEU . 4.4 tt0 -85.57 -48.03 9.31 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.024 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.968 HD12 HD21 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -96.34 -31.92 12.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.797 0.332 . . . . 0.0 110.479 179.645 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 104.31 46.28 1.35 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.546 -0.835 . . . . 0.0 113.315 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.968 HD21 HD12 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -127.25 -163.95 1.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.979 0.419 . . . . 0.0 111.331 179.227 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.432 ' O ' HG12 ' A' ' 45' ' ' ILE . 1.0 OUTLIER -97.96 148.64 23.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.017 -179.176 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -53.77 -40.45 66.27 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.099 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.661 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -71.96 -31.12 65.99 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 121.755 0.788 . . . . 0.0 109.247 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.597 ' NE2' HG21 ' A' ' 47' ' ' ILE . 3.2 tm0? -77.73 -14.82 59.49 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.177 -1.374 . . . . 0.0 110.273 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.825 HD13 ' HE1' ' A' ' 48' ' ' TRP . 5.9 mm -63.29 -57.19 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.227 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.464 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -58.39 -16.53 15.14 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.917 177.795 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.661 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -79.39 -39.64 20.98 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.143 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -178.639 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.852 ' CZ2' HD22 ' A' ' 34' ' ' LEU . 27.1 p-90 -74.06 -27.54 60.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 118.732 -1.187 . . . . 0.0 112.319 -178.06 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.79 ' HE2' HG22 ' A' ' 45' ' ' ILE . 7.4 m-85 -68.48 -46.29 70.1 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.267 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 13.1 pt20 -60.54 -25.6 66.26 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.829 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 . . . . . 0 N--CA 1.453 -0.322 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.985 178.742 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.66 ' HA ' HD11 ' A' ' 26' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.219 0 CA-C-O 120.778 0.323 . . . . 0.0 110.27 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.75 -44.1 1.68 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.117 0.484 . . . . 0.0 110.905 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.984 ' CE1' HD23 ' A' ' 26' ' ' LEU . 15.4 p90 -93.35 -45.94 7.58 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.096 -179.112 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.984 HD23 ' CE1' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -51.16 -27.28 8.29 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.325 0.583 . . . . 0.0 110.124 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.4 p -59.52 -21.87 60.82 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.94 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -131.37 1.32 4.14 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.712 178.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -115.91 -31.59 5.71 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 120.948 0.404 . . . . 0.0 111.009 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.441 ' HB3' ' HB2' ' A' ' 26' ' ' LEU . 4.8 ttt85 -117.57 -23.62 7.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.275 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.592 ' CG ' HG21 ' A' ' 45' ' ' ILE . 34.7 ttp180 -50.74 -30.06 12.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.045 0.45 . . . . 0.0 110.615 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.46 -31.1 62.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.338 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.471 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -75.86 -37.53 58.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.408 179.615 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.681 ' HB3' ' CH2' ' A' ' 48' ' ' TRP . 6.9 mt -68.29 -62.7 1.28 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 39.5 t -43.06 -30.17 0.41 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.196 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.6 t -79.18 -38.72 35.18 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.265 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.64 -15.81 31.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.074 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.709 ' HG ' ' CZ2' ' A' ' 48' ' ' TRP . 2.7 mm? -88.98 -27.58 20.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.631 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 58.91 65.52 3.43 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.719 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.811 HD22 ' CB ' ' A' ' 44' ' ' GLN . 0.5 OUTLIER -154.66 -164.78 1.9 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.993 0.425 . . . . 0.0 111.577 -178.889 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.428 ' O ' HG12 ' A' ' 45' ' ' ILE . 35.5 t30 -118.97 172.07 7.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.321 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.416 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 5.5 mt-10 -53.39 -23.53 9.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.678 0.275 . . . . 0.0 111.469 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.905 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -70.1 -9.45 55.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.933 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.811 ' CB ' HD22 ' A' ' 40' ' ' LEU . 17.2 mp0 -117.32 -26.65 6.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.053 0.454 . . . . 0.0 109.78 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.997 HG22 ' HE2' ' A' ' 49' ' ' PHE . 12.9 mm -57.41 -59.26 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.426 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -55.9 -25.54 43.33 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.129 179.281 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.905 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -62.89 -32.51 56.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.748 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.724 ' CZ2' HD13 ' A' ' 45' ' ' ILE . 1.1 m0 -70.89 -63.93 1.0 Allowed 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.523 0.678 . . . . 0.0 110.229 179.537 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.997 ' HE2' HG22 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -61.97 -24.22 66.88 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.82 -179.244 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.3 mt-30 -56.88 -29.15 62.68 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.211 179.344 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.798 ' HB2' HD11 ' A' ' 26' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.186 0 CA-C-O 121.568 0.699 . . . . 0.0 110.677 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.482 ' O ' HG23 ' A' ' 27' ' ' THR . 0.1 OUTLIER -93.66 -48.69 6.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.175 179.722 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.511 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 10.8 p90 -70.69 -43.84 68.21 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.682 -1.144 . . . . 0.0 111.696 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.798 HD11 ' HB2' ' A' ' 23' ' ' ASN . 1.2 pp -53.87 -20.64 6.23 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.201 0.524 . . . . 0.0 110.754 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.494 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 3.3 p -65.82 -19.06 65.75 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.037 178.417 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -135.08 16.29 3.5 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.726 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.409 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -118.5 -51.41 2.4 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.639 -179.761 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.531 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -132.81 7.88 4.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.467 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.494 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 47.3 ttt180 -80.06 -2.37 44.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.903 0.382 . . . . 0.0 110.867 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -97.59 -28.91 13.73 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -69.78 -35.33 74.8 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.56 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.051 HD23 HD21 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -66.31 -63.87 0.98 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.446 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.511 ' CB ' HD11 ' A' ' 45' ' ' ILE . 17.8 t -40.3 -31.79 0.15 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.943 -1.026 . . . . 0.0 111.539 179.557 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.47 -36.98 21.91 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.946 -179.236 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -85.09 -19.37 31.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.894 0.378 . . . . 0.0 111.07 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 1.051 HD21 HD23 ' A' ' 34' ' ' LEU . 4.4 mm? -78.3 -49.98 12.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.779 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 104.48 21.22 9.45 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.718 -0.673 . . . . 0.0 111.818 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.77 HD13 HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -109.02 -160.54 0.72 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.163 0.506 . . . . 0.0 111.101 -179.847 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -120.84 -101.04 0.42 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.486 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -129.63 -42.62 1.29 Allowed 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.722 0.296 . . . . 0.0 111.516 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.918 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -73.36 -2.78 23.58 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.763 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.475 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 17.8 mp0 -106.02 -23.29 12.68 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.858 HG22 ' HE2' ' A' ' 49' ' ' PHE . 38.5 mm -56.8 -61.21 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.869 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -15.37 11.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.796 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.918 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.4 mp -79.11 -36.19 18.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -178.254 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.927 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.68 -29.65 45.74 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 118.463 -1.295 . . . . 0.0 111.902 -179.155 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.858 ' HE2' HG22 ' A' ' 45' ' ' ILE . 4.5 m-85 -69.41 -42.19 75.4 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 119.683 -0.807 . . . . 0.0 109.187 178.253 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.467 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 5.8 pt20 -60.81 -28.77 69.03 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.968 179.495 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.056 178.916 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.529 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.136 0 CA-C-O 121.311 0.577 . . . . 0.0 109.855 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.66 -40.74 2.31 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.625 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.428 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 7.9 p90 -89.91 -36.71 14.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.292 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.529 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -54.05 -11.48 0.46 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.092 0.473 . . . . 0.0 111.183 -179.889 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.469 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -81.82 -20.67 38.57 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.779 179.654 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -132.97 11.38 4.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.107 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.04 -42.11 2.04 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.809 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.408 ' HD3' ' CB ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -112.44 -14.82 13.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.362 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 ttm180 -51.78 -30.84 24.52 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.069 0.461 . . . . 0.0 110.399 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.3 -48.05 18.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.17 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -33.52 73.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.231 0.538 . . . . 0.0 109.817 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.803 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 5.1 mt -67.88 -57.27 6.52 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.515 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.46 -23.72 10.91 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.244 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.97 -27.67 23.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.387 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -111.08 29.49 7.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.785 0.326 . . . . 0.0 111.286 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.506 ' HG ' HD11 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -132.7 -56.33 0.94 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.239 0.542 . . . . 0.0 110.673 179.75 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 121.11 3.28 10.75 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.494 -0.776 . . . . 0.0 112.009 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.537 ' HB3' ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -94.22 -158.66 0.64 Allowed 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.329 0.585 . . . . 0.0 111.234 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -119.06 -59.82 1.81 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.494 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.403 ' O ' ' HB ' ' A' ' 45' ' ' ILE . 1.4 mt-10 174.72 -42.2 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.925 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -72.52 -12.04 60.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.288 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.537 ' HB2' ' HB3' ' A' ' 40' ' ' LEU . 17.6 mp0 -101.28 -15.78 17.17 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.931 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 2.7 mm -63.02 -58.74 6.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.765 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.457 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.465 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 2.6 mtmt -56.97 -19.09 16.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.047 178.028 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.925 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -78.12 -47.25 25.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 113.75 1.019 . . . . 0.0 113.75 -178.397 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.931 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 40.9 p-90 -65.53 -25.06 67.28 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 119.171 -1.012 . . . . 0.0 112.176 -177.549 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.683 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 23.3 m-85 -69.14 -53.96 17.4 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 176.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.559 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.4 pt20 -57.04 -28.52 62.59 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.9 179.456 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 N--CA 1.453 -0.302 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.883 178.653 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.549 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.8 OUTLIER . . . . . 0 CA--C 1.519 -0.218 0 CA-C-O 121.887 0.851 . . . . 0.0 109.632 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.95 -27.91 12.69 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.288 -1.324 . . . . 0.0 110.868 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.513 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.0 p90 -107.45 -44.81 4.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.85 -178.417 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.549 HD21 ' HA ' ' A' ' 23' ' ' ASN . 1.1 pp -50.61 -26.21 5.09 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.237 0.541 . . . . 0.0 110.601 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.462 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 1.2 p -65.39 -19.5 65.97 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.331 -0.849 . . . . 0.0 109.768 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -133.73 7.44 3.79 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.248 178.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.428 ' N ' ' O ' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -110.81 -50.37 2.96 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.394 179.99 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.412 ' HG2' ' HB2' ' A' ' 26' ' ' LEU . 7.4 ptm180 -117.74 -9.02 10.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.207 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.492 ' HG3' HG21 ' A' ' 45' ' ' ILE . 4.5 ttp85 -54.08 -27.91 35.75 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.968 0.413 . . . . 0.0 110.589 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -82.65 -27.63 31.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.628 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -77.52 -40.1 43.84 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.921 179.054 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.867 ' O ' HD22 ' A' ' 38' ' ' LEU . 0.2 OUTLIER -64.25 -59.5 4.33 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.574 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.595 ' CB ' HD11 ' A' ' 45' ' ' ILE . 32.6 t -38.75 -32.82 0.09 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.353 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.7 m -80.49 -27.1 37.86 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.448 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.584 ' N ' ' O ' ' A' ' 34' ' ' LEU . 8.9 tm-20 -73.74 -61.26 1.9 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.884 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 1.105 HD23 HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -53.88 -53.25 55.15 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.105 0.478 . . . . 0.0 110.396 179.783 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.55 36.09 1.64 Allowed Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.595 -179.191 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 1.105 HD11 HD23 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -117.57 -160.53 0.78 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.144 0.497 . . . . 0.0 111.398 -179.442 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -118.62 -101.32 0.43 Allowed 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.645 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -128.14 -44.22 1.45 Allowed 'General case' 0 C--O 1.231 0.098 0 CA-C-O 120.689 0.281 . . . . 0.0 111.636 -179.237 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.925 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -72.56 -2.79 21.21 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.788 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.5 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 18.0 mp0 -106.57 -21.99 12.9 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.347 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.899 HG22 ' HE2' ' A' ' 49' ' ' PHE . 42.1 mm -58.03 -61.57 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 178.783 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.41 ' HG3' HD12 ' A' ' 47' ' ' ILE . 14.6 ptpt -57.68 -16.45 10.78 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.667 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.925 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -76.3 -39.96 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -178.529 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.864 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -74.23 -41.44 61.33 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 118.797 -1.161 . . . . 0.0 111.846 -179.111 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.899 ' HE2' HG22 ' A' ' 45' ' ' ILE . 2.1 m-85 -57.57 -34.3 69.06 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 119.425 -0.91 . . . . 0.0 108.968 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -50.79 -28.22 8.85 Favored 'General case' 0 C--O 1.231 0.081 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.948 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.1 m120 . . . . . 0 N--CA 1.453 -0.283 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.264 179.149 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.546 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 8.3 m-20 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 121.193 0.521 . . . . 0.0 110.231 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.23 -44.55 1.88 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.365 -178.759 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.441 ' H ' ' HD1' ' A' ' 25' ' ' TYR . 3.5 p90 -88.19 -34.17 17.9 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.135 -178.55 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.546 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER -55.26 -8.94 0.36 Allowed 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.233 -179.861 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.462 HG23 HD23 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -91.52 11.34 24.4 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.179 179.839 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.72 -42.35 0.07 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.212 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.84 -55.43 4.99 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.452 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.531 ' HD3' HD12 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -89.07 -20.63 24.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.725 179.6 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.883 ' HD2' HG21 ' A' ' 45' ' ' ILE . 0.6 OUTLIER -59.44 -43.64 93.09 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.645 179.838 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -64.69 -29.01 70.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.944 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.448 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.21 -40.02 38.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.777 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.681 HD13 ' CZ3' ' A' ' 48' ' ' TRP . 10.8 mt -70.37 -59.04 3.1 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.361 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.836 ' OG ' HD11 ' A' ' 45' ' ' ILE . 2.2 t -39.51 -33.15 0.15 Allowed 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.38 178.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.82 -38.23 46.8 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.517 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 34' ' ' LEU . 5.4 mt-10 -88.88 -18.8 26.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.51 -179.729 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.741 ' HB3' HD22 ' A' ' 40' ' ' LEU . 4.2 mm? -89.11 -1.06 57.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.63 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 48.93 69.3 1.03 Allowed Glycine 0 C--N 1.335 0.487 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.876 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.741 HD22 ' HB3' ' A' ' 38' ' ' LEU . 1.8 pt? -154.22 -150.85 0.34 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.357 0.598 . . . . 0.0 111.676 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -136.1 -89.71 0.3 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.692 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.485 ' HA ' HG13 ' A' ' 45' ' ' ILE . 2.5 tt0 -137.08 -46.9 0.58 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.798 0.332 . . . . 0.0 111.541 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.446 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -65.23 -19.61 66.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.685 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.788 ' HA ' HD13 ' A' ' 47' ' ' ILE . 14.4 mp0 -95.36 -18.57 20.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.984 0.421 . . . . 0.0 110.105 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.926 HD13 ' CZ2' ' A' ' 48' ' ' TRP . 7.7 mm -54.71 -47.47 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.047 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.455 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -68.39 -10.59 56.14 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.789 178.172 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.788 HD13 ' HA ' ' A' ' 44' ' ' GLN . 1.1 mp -73.57 -32.34 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.381 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.926 ' CZ2' HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -71.44 -54.45 10.61 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.557 179.513 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.856 ' HE2' HG22 ' A' ' 45' ' ' ILE . 1.5 m-85 -64.09 -39.12 93.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.667 -178.788 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.46 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 3.6 pt20 -58.95 -24.93 63.07 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.316 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.471 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.567 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 121.092 0.472 . . . . 0.0 110.463 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -133.69 -32.72 1.11 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.664 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.503 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 16.7 p90 -105.09 -45.38 4.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.255 -0.429 . . . . 0.0 112.151 -178.431 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.572 HD23 ' H ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -46.34 -35.23 5.2 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.656 0.741 . . . . 0.0 109.939 -179.696 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.449 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -51.52 -25.78 7.29 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.11 178.629 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -136.05 24.61 3.3 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.326 179.356 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.22 -52.03 0.96 Allowed 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.992 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.503 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -133.06 18.24 4.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.342 179.963 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 26' ' ' LEU . 44.0 ttp85 -67.38 -41.67 84.64 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.188 0.518 . . . . 0.0 109.8 179.492 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -43.0 91.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.226 179.374 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -32.51 68.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.181 0.515 . . . . 0.0 109.912 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.8 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 5.8 mt -67.39 -57.85 5.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.338 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.4 t -51.25 -25.88 6.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.168 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.0 m -91.46 -20.34 21.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.416 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -114.34 27.77 9.24 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.812 0.339 . . . . 0.0 111.024 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.49 ' HG ' HD11 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -134.27 -59.57 0.82 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.122 0.487 . . . . 0.0 110.633 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 128.22 -6.96 6.76 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.754 -179.066 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.49 HD11 ' HG ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -91.27 -158.66 0.57 Allowed 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.288 0.566 . . . . 0.0 111.065 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -118.93 -71.67 0.73 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.262 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.405 ' HA ' HG13 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -169.68 -44.31 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.971 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -64.41 -18.58 64.84 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.999 178.447 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.444 ' HB2' ' HB3' ' A' ' 40' ' ' LEU . 24.3 mp0 -98.82 -17.71 18.31 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.817 178.916 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.933 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 3.5 mm -62.22 -59.29 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.567 178.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.501 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 6.6 pttt -56.68 -18.74 13.32 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.22 178.382 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.971 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -79.09 -48.84 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 -178.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.933 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 44.1 p-90 -64.39 -25.38 67.99 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 119.373 -0.931 . . . . 0.0 112.323 -177.247 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.703 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 27.0 m-85 -66.94 -52.8 38.59 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 177.205 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -56.23 -27.3 54.44 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.997 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 . . . . . 0 N--CA 1.452 -0.332 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.842 178.834 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.826 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.455 -0.204 0 CA-C-O 121.604 0.716 . . . . 0.0 110.361 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.411 ' HG3' ' N ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -99.5 -43.25 6.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.422 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.52 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 12.4 p90 -79.75 -44.25 21.07 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.656 -1.157 . . . . 0.0 111.79 -179.042 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.826 HD21 ' HA ' ' A' ' 23' ' ' ASN . 0.5 OUTLIER -50.05 -27.62 5.86 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.342 0.592 . . . . 0.0 110.319 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.475 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 2.3 p -61.37 -20.24 62.79 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.725 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -136.37 12.35 3.26 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.521 179.05 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.84 -29.97 4.21 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.042 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.451 ' HG3' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -146.64 20.25 1.32 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.784 179.886 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.475 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 2.3 ttt180 -88.57 -44.0 10.97 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 121.044 0.449 . . . . 0.0 109.813 179.35 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 -59.75 -28.85 67.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.817 -0.628 . . . . 0.0 109.799 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.511 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -67.73 -34.87 77.69 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.271 179.421 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.006 HD23 HD21 ' A' ' 38' ' ' LEU . 0.9 OUTLIER -71.97 -61.41 1.8 Allowed 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.431 179.295 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.48 ' HA ' HD12 ' A' ' 40' ' ' LEU . 10.7 t -44.72 -29.5 0.78 Allowed 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.878 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.52 -26.43 18.78 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.179 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 34' ' ' LEU . 4.3 tt0 -106.04 20.11 19.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.786 0.327 . . . . 0.0 110.88 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 1.006 HD21 HD23 ' A' ' 34' ' ' LEU . 2.7 mm? -118.72 -43.43 2.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.39 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 99.31 34.87 4.92 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.669 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.822 HD13 HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -123.93 -159.6 0.87 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.23 0.538 . . . . 0.0 111.646 -179.378 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.51 -84.82 0.65 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.794 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -147.07 -46.9 0.18 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.859 0.361 . . . . 0.0 110.681 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.987 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -67.6 -11.68 58.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.265 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.48 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 20.8 mp0 -97.65 -19.89 17.98 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.004 0.43 . . . . 0.0 109.969 179.222 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.822 HD13 HD13 ' A' ' 40' ' ' LEU . 44.8 mm -56.69 -61.39 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.668 178.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -59.58 -14.76 14.59 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.822 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.987 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -77.73 -37.58 24.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -178.541 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.826 ' CZ3' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -76.52 -33.41 58.6 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 118.505 -1.278 . . . . 0.0 111.975 -179.154 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.789 ' CZ ' ' CZ3' ' A' ' 48' ' ' TRP . 5.4 m-85 -66.94 -42.68 84.88 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 119.675 -0.81 . . . . 0.0 109.09 178.285 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.526 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 6.3 pt20 -62.84 -31.27 72.25 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 . . . . . 0 N--CA 1.452 -0.326 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.642 178.666 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.771 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.462 0.134 0 CA-C-O 121.145 0.497 . . . . 0.0 110.762 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.14 -38.34 1.23 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.12 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.557 ' CE1' HD23 ' A' ' 26' ' ' LEU . 19.6 p90 -94.27 -44.98 7.7 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.596 -178.654 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.771 HD21 ' HA ' ' A' ' 23' ' ' ASN . 0.3 OUTLIER -49.29 -29.64 6.25 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.358 0.599 . . . . 0.0 110.102 -179.564 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.412 ' H ' HG23 ' A' ' 27' ' ' THR . 1.2 p -57.79 -22.04 45.06 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.114 178.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -133.42 10.18 4.06 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.611 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -123.79 -40.65 2.3 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-O 120.969 0.414 . . . . 0.0 110.921 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.57 -12.51 10.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.085 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.683 ' CD ' HG21 ' A' ' 45' ' ' ILE . 3.6 ttt180 -56.96 -23.74 47.91 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.848 0.356 . . . . 0.0 110.81 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.01 -19.37 40.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.281 179.46 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.51 -46.24 11.04 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.27 179.488 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.893 HD22 ' CH2' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -63.51 -59.14 5.03 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.914 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.604 ' CB ' HD11 ' A' ' 45' ' ' ILE . 29.5 t -39.38 -32.76 0.13 Allowed 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.356 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.5 -27.82 41.44 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.194 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 34' ' ' LEU . 0.6 OUTLIER -73.39 -60.84 2.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.889 179.899 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 1.159 HD23 HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -56.29 -53.44 57.21 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.099 0.476 . . . . 0.0 110.41 179.846 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 114.12 43.15 0.8 Allowed Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.723 -179.277 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 1.159 HD11 HD23 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -129.63 -160.93 1.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.992 0.425 . . . . 0.0 111.398 -179.383 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.43 ' OD1' ' N ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -119.46 -91.58 0.55 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.16 -179.299 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.419 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 1.2 mp0 -136.77 -45.7 0.59 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.765 0.317 . . . . 0.0 111.333 -179.165 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.961 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -66.36 -11.76 52.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.265 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.492 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 16.9 mp0 -103.39 -21.33 13.82 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.904 HG22 ' HE2' ' A' ' 49' ' ' PHE . 42.5 mm -57.41 -61.14 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.492 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.473 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 9.4 ttmt -57.56 -17.0 11.73 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.757 178.785 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.961 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -77.3 -34.83 21.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 -178.257 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.893 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -79.83 -32.4 40.62 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 118.685 -1.206 . . . . 0.0 111.611 -179.488 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.904 ' HE2' HG22 ' A' ' 45' ' ' ILE . 3.7 m-85 -65.71 -41.49 92.24 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 119.655 -0.818 . . . . 0.0 109.179 178.398 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.474 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 5.1 pt20 -61.36 -26.33 67.75 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 121.075 0.464 . . . . 0.0 109.805 179.25 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.924 178.939 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.55 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 121.248 0.547 . . . . 0.0 109.803 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.45 -38.12 2.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.745 -178.441 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.429 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 8.8 p90 -92.68 -36.99 12.64 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.397 -178.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.55 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -53.94 -9.98 0.29 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.331 -179.944 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.527 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.5 OUTLIER -83.16 -22.69 33.2 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.649 179.617 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -133.09 16.04 4.18 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.069 178.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.0 tpt180 -121.26 -55.97 1.93 Allowed 'General case' 0 C--O 1.231 0.099 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.503 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.424 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -120.07 4.1 10.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.135 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.527 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.3 OUTLIER -56.86 -28.37 61.65 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 121.009 0.433 . . . . 0.0 110.318 179.454 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -79.13 -20.41 48.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.171 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.23 -44.99 11.04 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.663 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.831 HD22 HD21 ' A' ' 38' ' ' LEU . 0.6 OUTLIER -57.77 -45.82 85.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.787 179.107 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.557 ' HA ' HD11 ' A' ' 45' ' ' ILE . 1.8 t -48.01 -26.64 1.86 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.093 179.405 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.47 -10.58 21.99 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.509 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -76.3 -61.83 1.82 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.745 0.307 . . . . 0.0 111.062 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.931 HD23 ' CD1' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -71.36 -47.27 57.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.117 0.484 . . . . 0.0 110.239 179.66 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 123.35 4.47 8.3 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.465 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.931 ' CD1' HD23 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -106.71 -167.99 1.36 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.955 0.407 . . . . 0.0 111.208 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.611 ' O ' HG12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -113.8 171.62 7.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.894 -179.888 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.47 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 49.5 mt-10 -52.78 -39.0 61.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.575 -179.124 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.931 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -56.72 -23.5 42.86 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.316 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.548 ' HA ' ' HB ' ' A' ' 47' ' ' ILE . 16.9 mp0 -107.66 -21.77 12.75 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.666 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.935 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 10.8 mm -57.32 -57.79 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.28 179.148 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.444 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -59.84 -20.05 54.65 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.151 178.093 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.931 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.4 mp -79.2 -46.73 23.22 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -178.375 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.935 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 25.2 p-90 -66.54 -30.17 70.42 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 119.003 -1.079 . . . . 0.0 111.958 -177.763 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.747 ' HE2' HG22 ' A' ' 45' ' ' ILE . 21.5 m-85 -64.17 -53.52 48.09 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 177.083 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 10.4 pt20 -56.72 -25.65 55.0 Favored 'General case' 0 N--CA 1.457 -0.087 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.109 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.2 m-20 . . . . . 0 N--CA 1.454 -0.272 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.216 179.135 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.476 ' O ' ' CG ' ' A' ' 23' ' ' ASN . 0.9 OUTLIER . . . . . 0 CA--C 1.539 0.542 0 CA-C-O 120.98 0.419 . . . . 0.0 111.039 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.972 ' O ' HG23 ' A' ' 27' ' ' THR . 0.0 OUTLIER -138.22 -59.29 0.64 Allowed 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.354 0.597 . . . . 0.0 110.575 179.792 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.501 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 1.6 p90 -45.6 -29.87 1.33 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.013 179.322 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.56 HD23 ' C ' ' A' ' 24' ' ' ARG . 2.6 pt? -57.26 -10.8 1.41 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.76 -178.711 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.972 HG23 ' O ' ' A' ' 24' ' ' ARG . 1.3 p -93.51 -5.77 48.32 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.301 0.572 . . . . 0.0 109.63 179.486 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -148.51 22.35 1.03 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.015 179.066 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.408 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -151.59 -39.09 0.12 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.214 -179.524 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.417 ' H ' ' HA ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -128.9 32.2 4.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.024 179.645 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.556 ' HB3' ' HA ' ' A' ' 27' ' ' THR . 0.0 OUTLIER -96.58 -25.38 15.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.759 -179.7 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -99.62 -8.22 24.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.131 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.99 -38.68 8.49 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 178.663 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.994 HD21 ' CZ2' ' A' ' 48' ' ' TRP . 3.6 tt -68.01 -52.72 32.42 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.271 -1.331 . . . . 0.0 109.254 178.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.578 ' HA ' HD11 ' A' ' 38' ' ' LEU . 10.7 t -58.75 -20.71 51.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.443 179.066 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 75.2 m -91.1 -16.84 27.16 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.47 ' HG3' ' HG ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -100.82 23.56 10.42 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.381 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.892 HD13 HD12 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -166.94 16.39 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.617 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 45.59 32.89 4.33 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.025 -0.607 . . . . 0.0 113.351 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.933 HD13 ' CE2' ' A' ' 48' ' ' TRP . 11.6 mt -99.87 142.94 30.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.86 0.362 . . . . 0.0 110.43 179.578 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.473 ' O ' HG12 ' A' ' 45' ' ' ILE . 0.7 OUTLIER -68.41 141.14 55.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.247 -179.541 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.99 -33.76 18.89 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 121.184 0.516 . . . . 0.0 110.428 179.789 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.841 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -80.46 -33.01 37.03 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.778 0.799 . . . . 0.0 109.739 178.704 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.482 ' OE1' HD22 ' A' ' 40' ' ' LEU . 1.9 tm0? -77.44 -16.38 58.82 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.457 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.783 HG22 ' HE2' ' A' ' 49' ' ' PHE . 16.7 mm -62.43 -49.28 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.003 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 22.3 mtmt -70.86 -4.39 24.05 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.946 178.209 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.841 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.5 mp -86.45 -32.92 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -178.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.994 ' CZ2' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.81 -44.99 21.89 Favored 'General case' 0 N--CA 1.461 0.078 0 C-N-CA 118.113 -1.435 . . . . 0.0 111.141 179.689 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.783 ' HE2' HG22 ' A' ' 45' ' ' ILE . 6.0 m-85 -55.52 -43.86 76.13 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 120.104 -0.638 . . . . 0.0 109.625 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.49 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 4.6 pt20 -61.47 -24.77 66.8 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.177 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.355 179.294 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.435 ' O ' ' HG2' ' A' ' 24' ' ' ARG . 0.6 OUTLIER . . . . . 0 N--CA 1.461 0.124 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.677 ' O ' HG23 ' A' ' 27' ' ' THR . 0.5 OUTLIER -146.92 -46.01 0.18 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.761 0.791 . . . . 0.0 109.925 179.521 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.487 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 4.2 p90 -54.78 -38.2 66.97 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.596 -1.184 . . . . 0.0 110.337 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.51 HD23 ' H ' ' A' ' 26' ' ' LEU . 1.9 pt? -53.15 -26.77 18.16 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.696 -179.301 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.677 HG23 ' O ' ' A' ' 24' ' ' ARG . 6.6 p -67.01 -17.68 65.03 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.418 178.749 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -135.75 19.07 3.28 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.783 178.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.46 -46.71 1.75 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.664 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.412 ' HG3' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -135.8 11.33 3.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.499 179.993 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.475 ' N ' ' O ' ' A' ' 26' ' ' LEU . 1.4 ttm180 -64.66 -34.65 78.79 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.124 0.488 . . . . 0.0 110.111 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -76.91 -10.2 59.21 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.962 179.052 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.452 ' NE2' ' OE1' ' A' ' 37' ' ' GLU . 1.5 tm0? -102.85 -15.24 16.28 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.817 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.785 ' O ' HD13 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -102.0 -3.1 28.26 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.47 179.513 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.654 ' HA ' HD11 ' A' ' 45' ' ' ILE . 3.1 t -112.79 -3.18 14.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.637 179.603 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -116.27 -23.21 8.49 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.237 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.544 ' C ' HD12 ' A' ' 38' ' ' LEU . 0.7 OUTLIER -91.3 15.52 11.86 Favored 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 111.736 0.272 . . . . 0.0 111.736 -179.72 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.831 ' N ' HD12 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -158.89 23.11 0.21 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.721 0.296 . . . . 0.0 111.224 -179.08 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 53.2 22.61 14.63 Favored Glycine 0 CA--C 1.518 0.254 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.941 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.746 HD12 HD13 ' A' ' 38' ' ' LEU . 6.4 mt -89.75 -171.39 3.16 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.008 0.432 . . . . 0.0 110.828 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.524 ' O ' HG12 ' A' ' 45' ' ' ILE . 1.7 t30 -133.47 140.29 47.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.418 178.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -46.97 -27.97 1.47 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.086 0.47 . . . . 0.0 110.948 -179.553 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.586 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -78.85 -40.42 32.71 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.461 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.597 ' HA ' HD13 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -84.64 -11.8 55.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.353 -179.473 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.845 HG22 ' CE2' ' A' ' 49' ' ' PHE . 20.4 mm -55.77 -52.96 42.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.639 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.552 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 38.4 mtmt -63.3 -16.26 59.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.248 177.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.597 HD13 ' HA ' ' A' ' 44' ' ' GLN . 1.3 mp -79.94 -44.4 22.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -178.477 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.755 ' CZ2' HD22 ' A' ' 34' ' ' LEU . 13.3 p-90 -71.36 -27.38 63.31 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 118.645 -1.222 . . . . 0.0 111.95 -178.284 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.845 ' CE2' HG22 ' A' ' 45' ' ' ILE . 23.0 m-85 -66.25 -51.07 61.16 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 177.01 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.492 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.3 pt20 -58.05 -25.84 61.72 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.021 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 . . . . . 0 N--CA 1.453 -0.29 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.017 179.013 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.742 ' HA ' HD21 ' A' ' 26' ' ' LEU . 60.8 m-20 . . . . . 0 N--CA 1.465 0.293 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.1 ttm180 -138.29 -34.02 0.66 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 -177.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.591 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 13.3 p90 -110.47 -50.25 2.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.724 0.297 . . . . 0.0 111.368 -178.703 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.742 HD21 ' HA ' ' A' ' 23' ' ' ASN . 1.4 pt? -45.64 -34.61 3.55 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.364 0.602 . . . . 0.0 110.005 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.44 ' HB ' ' NH1' ' A' ' 31' ' ' ARG . 1.1 p -52.07 -25.69 9.27 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.884 178.737 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -132.1 27.94 4.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.878 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.99 -46.28 0.35 Allowed 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.016 -179.357 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.517 ' HG2' ' O ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -113.14 -18.27 12.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.011 -179.627 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.44 ' NH1' ' HB ' ' A' ' 27' ' ' THR . 5.6 ttm180 -50.46 -30.97 13.91 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.049 0.452 . . . . 0.0 110.553 179.656 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -72.95 -35.12 66.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.192 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.472 ' HG3' ' HG2' ' A' ' 30' ' ' ARG . 0.5 OUTLIER -74.29 -37.63 63.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.021 179.34 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.894 ' O ' HD22 ' A' ' 38' ' ' LEU . 5.8 mt -64.22 -50.09 69.39 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.928 179.267 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.7 t -45.69 -28.7 1.06 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.263 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -97.22 -14.1 21.62 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.74 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.505 ' HB3' HD13 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -84.66 -66.56 0.88 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.6 0.238 . . . . 0.0 111.258 -179.713 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.916 HD23 ' CD1' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -60.25 -50.12 74.93 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.033 0.444 . . . . 0.0 110.65 -179.919 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 127.5 -1.93 7.04 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.359 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.916 ' CD1' HD23 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -96.48 -161.75 0.9 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.913 0.387 . . . . 0.0 110.944 179.867 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -112.26 -100.75 0.41 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.519 -179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -133.21 -47.45 0.84 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.779 0.323 . . . . 0.0 110.916 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.991 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -60.97 -14.79 25.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.894 179.336 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.443 ' HA ' ' HB ' ' A' ' 47' ' ' ILE . 15.9 mp0 -102.32 -20.65 14.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.885 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 8.4 mm -60.42 -59.61 3.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.635 178.902 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.454 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 15.9 mtmt -58.11 -17.82 20.91 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.26 178.268 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.991 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.4 mp -80.26 -43.21 21.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -178.409 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.885 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 32.4 p-90 -70.72 -26.95 63.63 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 118.904 -1.119 . . . . 0.0 112.197 -177.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.764 ' HE2' HG22 ' A' ' 45' ' ' ILE . 10.8 m-85 -67.97 -49.33 62.34 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.184 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.9 pt20 -59.35 -25.67 64.42 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.996 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 . . . . . 0 N--CA 1.454 -0.259 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.946 178.869 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.543 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 1.1 m-80 . . . . . 0 C--O 1.232 0.136 0 CA-C-O 121.106 0.479 . . . . 0.0 109.986 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.95 -33.44 3.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.209 -178.019 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.483 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.2 p90 -100.24 -38.67 8.4 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.524 -178.084 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.57 HD23 HG23 ' A' ' 27' ' ' THR . 0.5 OUTLIER -54.1 -9.77 0.29 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.346 -179.77 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.57 HG23 HD23 ' A' ' 26' ' ' LEU . 1.0 OUTLIER -84.8 -16.71 40.54 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.871 179.77 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -138.8 15.07 2.69 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.315 179.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.13 -48.14 2.12 Favored 'General case' 0 CA--C 1.522 -0.103 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.379 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.402 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.5 OUTLIER -126.36 2.7 7.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.13 179.654 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.543 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.0 OUTLIER -60.41 -21.25 62.01 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 120.98 0.419 . . . . 0.0 110.741 179.391 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -88.34 -32.92 18.17 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 179.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.28 -36.31 79.18 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.851 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.819 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 12.7 mt -67.12 -60.64 2.45 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.837 179.58 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.2 t -50.48 -24.85 3.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.392 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 98.9 p -92.66 -33.78 14.23 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.676 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.41 24.39 9.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.707 0.289 . . . . 0.0 111.601 -179.526 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.714 HD21 ' CD2' ' A' ' 34' ' ' LEU . 1.8 mm? -128.1 -53.87 1.29 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.265 0.555 . . . . 0.0 110.507 179.599 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.71 -3.46 13.37 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.586 -178.71 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.476 HD13 ' HE1' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -94.92 -160.09 0.76 Allowed 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.399 0.618 . . . . 0.0 111.228 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.406 ' ND2' ' HG3' ' A' ' 42' ' ' GLU . 25.1 t30 -117.55 -80.79 0.61 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.902 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.406 ' HG3' ' ND2' ' A' ' 41' ' ' ASN . 0.1 OUTLIER -160.04 -43.49 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 179.662 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.945 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -67.53 -12.74 61.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.382 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.407 ' HB2' ' HB3' ' A' ' 40' ' ' LEU . 17.3 mp0 -102.19 -18.45 15.51 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.942 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 4.0 mm -62.21 -60.07 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.316 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.534 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -55.52 -19.69 10.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.22 178.332 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.945 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -77.85 -47.12 25.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -178.422 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.942 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 46.6 p-90 -67.67 -28.9 68.09 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 119.577 -0.849 . . . . 0.0 112.412 -177.361 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.719 ' HE2' HG22 ' A' ' 45' ' ' ILE . 17.5 m-85 -62.08 -43.79 98.07 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 177.348 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 47' ' ' ILE . 30.0 mt-30 -50.55 -34.08 24.2 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.04 179.238 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 . . . . . 0 N--CA 1.447 -0.614 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.071 179.581 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.841 ' HA ' HD22 ' A' ' 26' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 121.11 0.481 . . . . 0.0 110.659 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.12 -45.78 4.82 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.518 0.675 . . . . 0.0 110.897 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.509 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.8 p90 -76.18 -42.68 45.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.861 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.841 HD22 ' HA ' ' A' ' 23' ' ' ASN . 1.3 pt? -52.98 -22.12 5.26 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.101 0.477 . . . . 0.0 110.707 -179.063 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.583 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 2.7 p -64.72 -21.35 66.73 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.551 178.584 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -130.8 11.55 5.19 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.859 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.401 ' HB3' ' CD ' ' A' ' 30' ' ' ARG . 0.3 OUTLIER -110.61 -47.57 3.24 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.729 -179.885 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.594 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -144.62 14.7 1.58 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.741 179.695 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.583 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.1 OUTLIER -75.04 -35.69 61.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.016 0.436 . . . . 0.0 109.924 179.352 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.1 mp0 -61.39 -25.64 67.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.952 179.02 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.536 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.2 OUTLIER -61.37 -37.33 83.0 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.072 179.446 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.788 HD13 ' HZ3' ' A' ' 48' ' ' TRP . 1.0 OUTLIER -73.52 -61.99 1.64 Allowed 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.226 178.705 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.475 ' HB2' HD12 ' A' ' 45' ' ' ILE . 19.7 t -45.65 -27.28 0.76 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.956 178.857 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.3 t -96.35 -17.47 20.63 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.765 -179.76 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 34' ' ' LEU . 22.8 mt-10 -121.52 20.52 11.12 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.753 0.311 . . . . 0.0 111.024 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.723 ' CB ' HD11 ' A' ' 40' ' ' LEU . 1.6 mm? -110.12 -55.56 2.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.25 0.548 . . . . 0.0 110.364 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 108.77 35.6 2.37 Favored Glycine 0 N--CA 1.448 -0.536 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.125 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.723 HD11 ' CB ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -122.2 -157.11 0.72 Allowed 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.192 0.52 . . . . 0.0 111.143 -179.165 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -126.11 -106.45 0.33 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.737 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -125.78 -40.1 2.08 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.883 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -77.66 1.89 18.43 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.486 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 16.8 mp0 -108.42 -21.07 12.9 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.831 HG22 ' HE2' ' A' ' 49' ' ' PHE . 32.7 mm -57.39 -59.05 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.907 0 CA-C-O 121.271 0.558 . . . . 0.0 109.711 178.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt -61.09 -16.33 42.79 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.451 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.883 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -73.8 -38.68 51.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -178.835 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.788 ' HZ3' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -69.51 -47.86 62.43 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 118.92 -1.112 . . . . 0.0 111.235 -179.501 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.831 ' HE2' HG22 ' A' ' 45' ' ' ILE . 2.1 m-85 -63.32 -41.41 98.91 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 121.037 -0.265 . . . . 0.0 111.042 -179.398 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.527 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 5.0 pt20 -64.04 -26.17 68.44 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.177 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.345 179.155 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.596 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.158 0 CA-C-O 121.024 0.44 . . . . 0.0 110.741 . . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.76 -36.34 2.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.198 -179.549 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.514 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 25.2 p90 -96.93 -46.41 6.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.748 -178.635 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.596 HD21 ' HA ' ' A' ' 23' ' ' ASN . 0.2 OUTLIER -48.58 -31.27 6.33 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.516 0.674 . . . . 0.0 109.641 179.84 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.55 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 1.4 p -53.65 -24.7 15.08 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.951 178.496 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -133.65 17.69 3.93 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.997 178.769 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.436 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -120.33 -50.0 2.25 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.697 -179.869 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.42 6.59 3.82 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.577 179.99 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.662 ' CG ' HG21 ' A' ' 45' ' ' ILE . 47.4 ttt180 -75.62 -7.34 54.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.701 0.286 . . . . 0.0 111.182 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -94.66 -23.33 17.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.356 0.598 . . . . 0.0 109.484 178.901 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -80.82 -42.77 21.09 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.888 179.037 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.996 ' CD2' HD21 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -63.51 -58.91 5.49 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.045 179.064 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.513 ' CB ' HD11 ' A' ' 45' ' ' ILE . 32.8 t -41.74 -32.32 0.38 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.272 179.331 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.5 m -89.71 -33.06 16.74 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.846 179.83 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.403 ' N ' ' O ' ' A' ' 34' ' ' LEU . 36.0 tt0 -67.32 -14.75 63.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.467 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.996 HD21 ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -112.04 -44.93 3.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.776 0.322 . . . . 0.0 110.722 -179.763 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 109.73 46.07 0.93 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.912 179.475 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.904 HD11 HD13 ' A' ' 38' ' ' LEU . 0.4 OUTLIER -144.85 -168.51 2.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.755 0.312 . . . . 0.0 111.011 179.689 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.697 ' O ' HG12 ' A' ' 45' ' ' ILE . 4.9 p30 -129.7 -175.15 3.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.86 -179.722 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.521 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 9.0 mt-10 -49.23 -34.69 15.56 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -177.939 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.835 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -63.19 -23.18 67.31 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -178.814 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.558 ' HB2' HD22 ' A' ' 40' ' ' LEU . 18.5 mp0 -112.03 -19.13 12.44 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 121.034 -0.266 . . . . 0.0 110.796 -179.272 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.907 HG22 ' HE2' ' A' ' 49' ' ' PHE . 38.8 mm -52.12 -60.73 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.845 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.454 ' HG3' HD12 ' A' ' 47' ' ' ILE . 34.6 pttt -59.21 -19.9 49.41 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.661 178.856 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.835 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.7 mp -78.63 -40.78 24.32 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -178.409 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.903 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -72.84 -31.94 65.11 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 118.513 -1.275 . . . . 0.0 112.296 -178.227 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.907 ' HE2' HG22 ' A' ' 45' ' ' ILE . 9.1 m-85 -66.4 -44.66 82.4 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 119.608 -0.837 . . . . 0.0 109.374 178.474 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.511 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 1.5 pt20 -58.63 -27.23 64.51 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.207 179.751 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.2 179.138 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.553 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.92 0.39 . . . . 0.0 110.562 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -126.79 -35.45 2.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.32 -178.078 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.418 ' C ' ' H ' ' A' ' 27' ' ' THR . 4.7 p90 -101.89 -34.94 9.19 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.379 -178.211 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.553 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -55.11 -10.12 0.49 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.068 179.725 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.525 HG23 HD23 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -86.73 -16.87 35.11 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.931 179.92 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -140.08 17.74 2.45 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.193 179.218 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -127.41 -53.15 1.37 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.826 -179.559 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.414 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.8 OUTLIER -121.76 3.98 10.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.449 -179.947 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.59 -38.69 69.74 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.069 0.461 . . . . 0.0 110.304 179.669 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -71.88 -46.42 57.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.246 179.253 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.48 -32.85 65.39 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.266 0.555 . . . . 0.0 109.932 179.087 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.822 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 5.0 mt -67.51 -55.95 11.49 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.686 179.845 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.642 ' HA ' HD11 ' A' ' 45' ' ' ILE . 3.8 t -59.34 -21.12 59.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.035 -179.76 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.0 t -95.26 -14.16 24.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.569 -179.643 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -106.12 -29.05 10.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.01 0.433 . . . . 0.0 110.507 179.843 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.603 ' CB ' HD11 ' A' ' 40' ' ' LEU . 4.0 mm? -78.89 -58.55 3.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.749 179.778 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 109.81 15.98 11.34 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.813 -179.114 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.603 HD11 ' CB ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -107.98 -162.64 0.84 Allowed 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.144 0.497 . . . . 0.0 111.361 -179.851 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.44 ' CB ' ' HB2' ' A' ' 44' ' ' GLN . 0.7 OUTLIER -97.3 146.79 24.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.337 -179.783 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -52.19 -36.7 52.65 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 121.218 0.532 . . . . 0.0 109.904 179.573 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.561 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -75.77 -33.97 60.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.104 178.239 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.648 ' NE2' HG21 ' A' ' 47' ' ' ILE . 2.9 tm0? -75.82 -13.79 60.29 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.828 179.715 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.884 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 3.0 mm -65.53 -56.91 13.0 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.494 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.51 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.558 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 30.4 mtmt -54.45 -18.82 4.67 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.962 177.71 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.648 HG21 ' NE2' ' A' ' 44' ' ' GLN . 1.2 mp -76.1 -46.19 34.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -178.851 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.884 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 34.4 p-90 -68.19 -28.21 67.06 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 119.553 -0.859 . . . . 0.0 112.651 -177.453 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.788 ' HE2' HG22 ' A' ' 45' ' ' ILE . 12.1 m-85 -63.61 -42.54 98.21 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.542 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -56.78 -33.54 66.76 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.679 179.147 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 . . . . . 0 N--CA 1.452 -0.357 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.126 179.204 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.54 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 121.273 0.559 . . . . 0.0 109.633 . . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.85 -42.12 2.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.146 -0.933 . . . . 0.0 111.453 -178.545 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.435 ' C ' ' H ' ' A' ' 27' ' ' THR . 6.9 p90 -88.92 -35.77 16.29 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.279 -178.692 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.54 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER -54.26 -9.02 0.24 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.15 0.5 . . . . 0.0 111.371 -179.891 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.484 HG23 HD23 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -88.01 -19.51 27.07 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.927 179.941 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -132.57 12.4 4.48 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.975 178.591 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.22 -44.44 1.14 Allowed 'General case' 0 C--O 1.231 0.098 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.111 179.981 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.427 ' HD3' ' CB ' ' A' ' 26' ' ' LEU . 14.9 mtp180 -110.97 -3.56 15.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.896 179.548 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -11.09 39.38 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.737 0.303 . . . . 0.0 111.066 179.773 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -95.91 -19.78 19.27 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.718 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.93 -47.89 8.61 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.994 179.234 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.965 HD22 ' CZ3' ' A' ' 48' ' ' TRP . 0.5 OUTLIER -61.66 -48.35 81.22 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.87 179.764 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.708 ' O ' HD12 ' A' ' 40' ' ' LEU . 6.1 t -50.49 -37.23 37.61 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.892 179.213 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.5 t -98.6 7.7 45.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.472 179.131 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.487 ' C ' HD12 ' A' ' 38' ' ' LEU . 11.5 tt0 -92.88 -38.48 11.7 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.583 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.758 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -107.82 19.57 19.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.353 -179.406 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 56.25 63.67 5.1 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.478 -0.867 . . . . 0.0 111.455 -179.185 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.734 HD13 ' HZ2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -137.93 -160.33 1.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.203 0.525 . . . . 0.0 111.952 -178.428 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.461 ' ND2' ' H ' ' A' ' 42' ' ' GLU . 2.5 p-10 -142.7 -83.89 0.17 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.001 179.97 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.461 ' H ' ' ND2' ' A' ' 41' ' ' ASN . 6.0 mp0 -141.45 -39.54 0.39 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.898 0.38 . . . . 0.0 110.633 -179.588 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.836 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -66.44 -12.96 59.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.691 -179.953 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.514 ' HB2' ' HB3' ' A' ' 40' ' ' LEU . 19.7 mp0 -111.88 -26.26 9.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.804 0.335 . . . . 0.0 110.53 -179.914 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.819 HG22 ' HE1' ' A' ' 49' ' ' PHE . 8.9 mm -60.52 -64.06 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.747 0 CA-C-O 121.352 0.596 . . . . 0.0 110.24 179.574 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -55.72 -21.85 20.76 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.322 179.576 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.836 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -64.35 -35.96 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.229 -179.642 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.965 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -71.69 -58.61 3.33 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.485 179.686 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.819 ' HE1' HG22 ' A' ' 45' ' ' ILE . 0.4 OUTLIER -60.26 -25.48 65.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.703 -179.563 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -57.08 -29.95 63.91 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.066 0.46 . . . . 0.0 110.03 179.22 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.326 179.326 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.419 ' O ' HD21 ' A' ' 26' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.082 0 CA-C-O 121.214 0.531 . . . . 0.0 111.082 . . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.646 ' O ' HG23 ' A' ' 27' ' ' THR . 24.0 mtm105 -100.26 -49.28 4.32 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.754 0.787 . . . . 0.0 110.412 179.853 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.518 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 4.7 p90 -47.75 -39.81 18.9 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.412 -1.267 . . . . 0.0 111.178 -179.876 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.518 ' N ' ' CG ' ' A' ' 25' ' ' TYR . 3.8 pp -51.19 -30.49 17.24 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.862 -179.074 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.646 HG23 ' O ' ' A' ' 24' ' ' ARG . 16.5 p -63.13 -19.27 64.3 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.3 -0.863 . . . . 0.0 109.832 179.163 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -131.94 8.05 4.41 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.481 178.748 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -113.27 -43.69 3.33 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.826 179.937 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.446 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -128.32 -1.36 5.67 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.616 179.853 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.827 ' NE ' HG21 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -72.9 -11.16 60.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.786 0.327 . . . . 0.0 110.981 179.702 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -102.66 -21.23 14.15 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.004 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -81.97 -41.14 21.2 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.112 179.294 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.65 HD13 ' CZ3' ' A' ' 48' ' ' TRP . 10.4 mt -67.79 -59.67 3.13 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.46 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.8 ' OG ' HD11 ' A' ' 45' ' ' ILE . 4.7 t -38.53 -32.94 0.09 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.675 178.756 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.8 t -81.06 -38.32 27.57 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.926 -179.334 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -86.95 -27.24 23.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.814 0.34 . . . . 0.0 111.473 -179.494 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.796 ' HB3' HD22 ' A' ' 40' ' ' LEU . 3.5 mm? -78.32 -2.93 40.45 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.643 -179.667 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 50.64 68.63 1.38 Allowed Glycine 0 C--N 1.334 0.469 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.608 179.884 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.796 HD22 ' HB3' ' A' ' 38' ' ' LEU . 1.9 pt? -153.21 -151.88 0.39 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.285 0.564 . . . . 0.0 111.694 -179.188 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -136.78 -84.12 0.35 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.804 -179.629 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.485 ' HA ' HG13 ' A' ' 45' ' ' ILE . 11.5 tt0 -141.01 -46.77 0.4 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.854 0.359 . . . . 0.0 111.487 -179.297 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.556 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -64.91 -17.43 64.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.716 -179.659 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.77 ' HA ' HD13 ' A' ' 47' ' ' ILE . 16.6 mp0 -98.56 -18.14 18.31 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.271 179.842 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.937 HD13 ' CZ2' ' A' ' 48' ' ' TRP . 6.8 mm -55.35 -46.61 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 178.154 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.36 -10.76 59.36 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.869 -1.059 . . . . 0.0 109.755 178.099 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.77 HD13 ' HA ' ' A' ' 44' ' ' GLN . 1.2 mp -73.08 -33.2 41.85 Favored 'Isoleucine or valine' 0 C--N 1.342 0.277 0 C-N-CA 121.016 -0.274 . . . . 0.0 111.234 -179.926 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.937 ' CZ2' HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -70.87 -60.5 2.2 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.322 179.606 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.854 ' HE2' HG22 ' A' ' 45' ' ' ILE . 1.0 OUTLIER -58.84 -30.07 67.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.509 -179.735 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -51.0 -26.85 6.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.103 0.478 . . . . 0.0 109.938 178.961 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.201 179.106 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.409 ' HA ' HD22 ' A' ' 26' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.462 0.135 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 . . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.624 ' O ' HG23 ' A' ' 27' ' ' THR . 8.0 mmt180 -148.2 -46.22 0.16 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.774 0.797 . . . . 0.0 109.976 179.556 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.51 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 6.1 p90 -58.02 -39.05 77.39 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.546 -1.206 . . . . 0.0 110.248 179.811 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.573 ' HA ' ' HB3' ' A' ' 29' ' ' ARG . 2.1 pt? -52.67 -30.12 30.22 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.342 -179.564 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.624 HG23 ' O ' ' A' ' 24' ' ' ARG . 3.7 p -64.28 -18.33 64.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.661 178.918 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -137.04 19.91 3.0 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.078 178.829 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.573 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.7 OUTLIER -126.1 -41.57 1.92 Allowed 'General case' 0 C--O 1.231 0.11 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.089 -179.454 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.484 ' HD3' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -149.7 19.98 0.91 Allowed 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.766 0.284 . . . . 0.0 111.766 -179.781 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.532 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.6 OUTLIER -81.47 -26.11 35.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.858 0.361 . . . . 0.0 110.474 179.687 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -86.46 -21.65 26.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.173 179.145 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.5 -45.14 12.93 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.082 179.344 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.901 HD22 ' CH2' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -62.88 -57.65 10.08 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.814 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.584 ' CB ' HD11 ' A' ' 45' ' ' ILE . 29.9 t -40.53 -32.98 0.23 Allowed 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.186 179.718 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.36 -30.08 47.79 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.856 179.727 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.564 ' N ' ' O ' ' A' ' 34' ' ' LEU . 31.5 mt-10 -71.28 -57.13 4.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.811 179.812 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 1.054 HD23 HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.39 -47.43 85.47 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.125 0.488 . . . . 0.0 110.34 179.7 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.31 30.9 5.48 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.333 -178.837 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 1.054 HD11 HD23 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -126.61 -168.29 1.84 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.019 0.437 . . . . 0.0 111.343 -179.48 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.6 ' O ' HG12 ' A' ' 45' ' ' ILE . 2.5 p-10 -124.09 176.83 6.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.064 179.878 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.44 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 13.6 mp0 -46.85 -30.93 2.74 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.006 -178.675 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.712 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -63.63 -19.85 65.2 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.115 -179.481 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.663 ' CB ' HD22 ' A' ' 40' ' ' LEU . 14.7 mp0 -118.72 -20.9 8.09 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.557 -179.023 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.875 HG22 ' HE2' ' A' ' 49' ' ' PHE . 46.9 mm -50.81 -58.08 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.473 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.431 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 1.5 mtmt -60.34 -25.08 65.55 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.481 178.391 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.712 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.6 mp -70.93 -39.31 75.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -178.585 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.901 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -74.45 -40.6 61.81 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 118.401 -1.32 . . . . 0.0 111.907 -178.859 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.875 ' HE2' HG22 ' A' ' 45' ' ' ILE . 2.8 m-85 -59.92 -33.74 72.27 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.347 -0.941 . . . . 0.0 108.663 178.025 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.4 ' NE2' ' O ' ' A' ' 46' ' ' LYS . 0.9 OUTLIER -49.32 -27.81 4.26 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.909 179.163 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.218 179.319 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.163 0 N-CA-C 112.524 -0.231 . . . . 0.0 112.524 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.7 -174.96 5.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.78 0.324 . . . . 0.0 110.909 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -136.8 46.63 2.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.815 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 15.5 tttp -177.09 66.18 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.819 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.7 mmp_? -114.64 149.28 42.03 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.946 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.37 -165.62 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.575 2.183 . . . . 0.0 112.235 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.09 48.96 1.77 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.529 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.646 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -135.7 -77.9 0.43 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.949 -179.684 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.646 ' H ' HG23 ' A' ' 6' ' ' THR . . . -67.76 -27.56 66.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.802 0.334 . . . . 0.0 110.782 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.777 ' CG ' HD21 ' A' ' 13' ' ' LEU . 0.0 OUTLIER 172.29 112.99 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.091 0.472 . . . . 0.0 111.06 179.606 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.502 ' O ' ' CB ' ' A' ' 10' ' ' SER . 0.0 OUTLIER -90.84 36.76 0.91 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.009 -179.563 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.502 ' CB ' ' O ' ' A' ' 9' ' ' SER . 5.5 t 90.35 -30.58 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.517 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -35.33 80.18 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.582 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.472 ' CB ' ' HB3' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -82.29 -31.07 30.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.797 178.885 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.777 HD21 ' CG ' ' A' ' 8' ' ' PHE . 11.7 mt -70.27 -34.23 72.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.972 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.62 -31.4 66.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.769 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -66.46 -35.37 80.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.776 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.64 68.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.83 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.683 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.2 OUTLIER -74.4 -59.1 2.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.19 179.491 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -29.36 60.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.084 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -63.03 -48.88 76.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.554 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.683 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.8 p90 -83.96 -25.55 29.97 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.657 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -53.73 -26.58 23.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.098 0.475 . . . . 0.0 109.881 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.712 ' C ' HD21 ' A' ' 26' ' ' LEU . 5.9 mt-10 -97.41 18.55 15.02 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.794 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.58 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -161.22 33.97 0.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.167 179.236 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.2 tpp180 -126.17 -35.59 2.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.228 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.493 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 20.5 p90 -100.58 -46.18 5.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.702 -178.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.712 HD21 ' C ' ' A' ' 22' ' ' GLU . 0.3 OUTLIER -48.69 -29.84 4.87 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.43 0.633 . . . . 0.0 110.0 -179.939 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.455 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.8 OUTLIER -55.2 -24.71 28.58 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.886 178.617 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.82 8.73 5.32 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.462 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.461 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.9 OUTLIER -112.58 -50.83 2.87 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.828 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.438 ' HD3' ' CB ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -119.93 -7.33 9.96 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.69 -179.797 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.525 ' NE ' HG21 ' A' ' 45' ' ' ILE . 10.2 ttt180 -53.44 -33.59 54.65 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.109 0.48 . . . . 0.0 110.389 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -74.03 -29.69 62.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.508 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.491 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -72.59 -38.95 67.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.461 179.807 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.72 ' HB3' ' CZ3' ' A' ' 48' ' ' TRP . 6.7 mt -70.86 -62.12 1.51 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.9 t -46.48 -29.45 1.76 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.913 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.9 m -73.81 -47.98 34.75 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.163 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.85 -10.7 56.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.024 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.691 ' HG ' ' CZ2' ' A' ' 48' ' ' TRP . 2.2 mm? -89.32 -27.73 20.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.661 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.64 65.51 3.38 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.925 -179.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.872 HD22 ' CB ' ' A' ' 44' ' ' GLN . 1.3 pp -157.34 -162.89 1.27 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.978 0.418 . . . . 0.0 111.312 -179.14 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.533 ' O ' HG12 ' A' ' 45' ' ' ILE . 19.4 m-20 -123.07 -177.68 3.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.611 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -58.36 -24.43 59.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.962 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.886 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -72.47 -4.9 33.14 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.872 ' CB ' HD22 ' A' ' 40' ' ' LEU . 16.7 mp0 -120.84 -25.7 5.37 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.951 0.405 . . . . 0.0 109.959 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 1.02 HG22 ' CE2' ' A' ' 49' ' ' PHE . 14.7 mm -57.36 -59.35 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.913 0 CA-C-O 121.661 0.743 . . . . 0.0 109.148 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.498 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 0.2 OUTLIER -55.75 -29.42 59.52 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.528 -1.215 . . . . 0.0 110.144 179.612 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.886 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -59.39 -32.79 49.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.682 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.72 ' CZ3' ' HB3' ' A' ' 34' ' ' LEU . 1.5 m0 -69.97 -63.9 0.99 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.522 0.677 . . . . 0.0 110.112 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 1.02 ' CE2' HG22 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -62.31 -28.22 69.58 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.561 -179.441 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.498 ' CB ' ' O ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -62.96 -32.96 74.4 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 178.86 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -86.82 -28.66 22.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.022 178.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.5 tttm -76.21 -26.92 56.6 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.689 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 37.5 mtt180 -58.37 -30.9 67.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.77 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -87.85 -53.28 4.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.061 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.41 ' O ' ' HB ' ' A' ' 56' ' ' ILE . 1.7 tttt 59.82 31.06 20.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.968 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.41 ' HB ' ' O ' ' A' ' 55' ' ' LYS . 3.7 mt 79.41 68.94 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 121.243 0.544 . . . . 0.0 110.76 -179.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.48 ' O ' ' HG2' ' A' ' 58' ' ' ARG . 43.0 mtt-85 -153.14 -41.88 0.1 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.125 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 0.8 OUTLIER 36.03 53.77 0.93 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.833 -179.994 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.961 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.188 0 N-CA-C 112.517 -0.233 . . . . 0.0 112.517 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -117.54 115.87 25.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.798 0.332 . . . . 0.0 110.935 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.39 51.3 0.35 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.84 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.1 mttm -146.93 51.47 1.1 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.825 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.683 HH22 HD11 ' A' ' 13' ' ' LEU . 47.3 mtp180 -111.95 139.41 22.3 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.895 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -86.24 -167.02 0.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.626 2.217 . . . . 0.0 112.392 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -144.96 52.41 1.22 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.264 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.709 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -129.98 -77.84 0.54 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.064 -179.452 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.709 ' H ' HG23 ' A' ' 6' ' ' THR . . . -59.1 -41.48 88.21 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.818 0.342 . . . . 0.0 110.591 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.936 ' CD2' HD22 ' A' ' 13' ' ' LEU . 0.0 OUTLIER 179.11 109.15 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.435 179.546 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.544 ' O ' ' CB ' ' A' ' 10' ' ' SER . 0.0 OUTLIER -98.29 38.57 1.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.681 -179.685 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.758 ' H ' HD21 ' A' ' 13' ' ' LEU . 4.9 t 94.95 -29.85 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.988 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -79.2 -3.73 47.14 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.753 -179.446 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.37 -4.48 13.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.805 0.336 . . . . 0.0 111.051 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.936 HD22 ' CD2' ' A' ' 8' ' ' PHE . 0.1 OUTLIER -116.09 -27.71 6.83 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.219 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.78 -28.97 68.81 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.834 178.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.3 ttp-105 -70.35 -40.51 74.02 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.463 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.44 -40.79 95.75 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.744 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.621 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -59.26 -46.69 87.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.171 179.493 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -74.17 -32.13 62.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.313 179.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -44.87 92.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.897 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.621 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.8 OUTLIER -87.45 -23.15 24.56 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.921 179.916 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -54.13 -27.95 36.65 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.53 -14.51 42.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.513 179.12 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.77 ' HB2' HD11 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -126.2 43.95 2.97 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.503 0.668 . . . . 0.0 110.616 179.247 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.37 -35.51 7.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.572 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.521 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.7 p90 -92.19 -44.34 8.83 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.926 -1.033 . . . . 0.0 111.767 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.77 HD11 ' HB2' ' A' ' 23' ' ' ASN . 0.3 OUTLIER -46.32 -27.33 1.01 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.315 0.579 . . . . 0.0 110.969 -179.13 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.431 HG23 ' H ' ' A' ' 27' ' ' THR . 1.1 p -58.57 -19.73 40.68 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.105 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -123.85 -17.72 6.23 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.438 178.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.441 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 4.6 tmt_? -96.21 -53.08 3.75 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-O 120.948 0.404 . . . . 0.0 110.503 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.525 ' HB2' ' HB2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -82.41 -27.82 31.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.392 179.438 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.555 ' HG3' HG21 ' A' ' 45' ' ' ILE . 27.4 ttt180 -49.77 -29.91 8.59 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 178.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -77.62 -32.48 53.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.383 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.511 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -77.84 -40.43 40.32 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.537 179.621 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.71 HD13 ' CZ3' ' A' ' 48' ' ' TRP . 1.5 mt -63.14 -54.05 43.78 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.082 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.1 t -41.72 -30.8 0.25 Allowed 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.734 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.3 m -120.52 14.97 11.99 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.459 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -105.85 -45.25 4.42 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.782 0.289 . . . . 0.0 111.782 -179.871 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 1.05 HD11 HD21 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -103.34 14.62 31.1 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -179.114 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.11 69.4 1.29 Allowed Glycine 0 CA--C 1.509 -0.343 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.577 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 1.05 HD21 HD11 ' A' ' 38' ' ' LEU . 0.9 OUTLIER -101.25 -164.91 1.15 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.859 0.362 . . . . 0.0 111.873 -179.251 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -126.55 16.55 7.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.038 -178.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.432 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 0.7 OUTLIER 66.9 7.81 5.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.67 0.271 . . . . 0.0 111.28 -179.841 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.783 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -117.62 -29.64 5.7 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.953 0.406 . . . . 0.0 110.533 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.516 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 1.9 mt-30 -88.43 -4.32 58.66 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.787 HG22 ' HE1' ' A' ' 49' ' ' PHE . 9.1 mm -60.41 -58.78 5.8 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.05 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.904 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.483 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 13.8 pttt -62.17 -19.32 62.96 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.909 -1.041 . . . . 0.0 109.631 178.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.783 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.7 mp -67.34 -34.89 71.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.785 ' CH2' HG23 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -69.82 -60.21 2.45 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 119.903 -0.719 . . . . 0.0 110.238 179.832 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.787 ' HE1' HG22 ' A' ' 45' ' ' ILE . 1.4 m-85 -57.73 -29.78 65.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.385 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.672 ' O ' ' HB3' ' A' ' 54' ' ' ALA . 0.0 OUTLIER -51.79 -29.83 20.64 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.084 0.469 . . . . 0.0 110.074 178.94 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -86.33 -29.49 22.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.612 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.35 -21.46 42.39 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.069 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.81 36.36 4.54 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.805 0.336 . . . . 0.0 111.099 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.672 ' HB3' ' O ' ' A' ' 50' ' ' GLN . . . -162.12 -56.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.243 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.412 ' O ' ' HB ' ' A' ' 56' ' ' ILE . 23.2 ttmt -86.7 -67.59 0.8 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.995 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.412 ' HB ' ' O ' ' A' ' 55' ' ' LYS . 3.7 mt 78.56 68.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.185 0.517 . . . . 0.0 110.806 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.69 -46.18 0.17 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.681 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -56.83 -31.6 64.92 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.977 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.5 t . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.149 -0.929 . . . . 0.0 110.923 179.967 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.097 0 N-CA-C 112.532 -0.227 . . . . 0.0 112.532 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -125.9 23.63 7.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.771 0.32 . . . . 0.0 111.087 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 61.93 46.18 6.87 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.792 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -158.35 57.65 0.45 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.791 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -91.67 146.75 33.72 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.847 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.435 ' HB2' HG22 ' A' ' 6' ' ' THR . 56.4 Cg_endo -70.6 -165.6 0.18 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.516 2.144 . . . . 0.0 112.282 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.462 ' HA ' ' HB3' ' A' ' 9' ' ' SER . 0.0 OUTLIER -128.9 44.56 2.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.235 0.54 . . . . 0.0 110.487 179.795 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.558 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -107.71 -77.07 0.6 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.731 -179.979 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.558 ' H ' HG23 ' A' ' 6' ' ' THR . . . -68.3 -29.0 67.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.633 179.559 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.786 ' CG ' HD21 ' A' ' 13' ' ' LEU . 0.0 OUTLIER 172.11 114.31 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.178 0.513 . . . . 0.0 110.991 179.505 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.486 ' O ' ' CB ' ' A' ' 10' ' ' SER . 1.4 p -89.3 35.14 0.8 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.909 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.486 ' CB ' ' O ' ' A' ' 9' ' ' SER . 3.4 m 90.16 -30.68 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.484 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -64.86 -36.96 86.02 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.901 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.48 ' CB ' ' HB3' ' A' ' 8' ' ' PHE . 4.6 mt-30 -78.3 -29.65 47.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.934 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.786 HD21 ' CG ' ' A' ' 8' ' ' PHE . 11.2 mt -71.05 -33.43 70.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.063 179.149 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.3 -37.14 63.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.704 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.4 tmm_? -80.23 -38.89 30.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.622 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.08 -28.91 70.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.968 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.641 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.1 OUTLIER -58.77 -44.44 90.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.5 179.786 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.05 -31.95 56.58 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.504 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.37 -42.47 87.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.009 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.641 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.6 OUTLIER -87.98 -24.41 23.55 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.061 179.994 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -48.5 -54.45 14.27 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.955 0.407 . . . . 0.0 110.356 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.404 ' O ' ' CE1' ' A' ' 25' ' ' TYR . 1.3 mp0 -73.17 -20.87 60.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.397 179.144 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.517 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 5.3 m-20 -102.56 31.62 4.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.295 0.569 . . . . 0.0 109.715 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -121.83 -38.75 2.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.821 -178.258 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.45 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 13.0 p90 -89.95 -39.01 13.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.545 -178.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.517 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 1.0 OUTLIER -53.05 -14.63 0.64 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 121.107 0.48 . . . . 0.0 111.089 -179.742 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.44 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -77.5 -20.43 54.31 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.811 179.52 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -133.98 14.18 3.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.116 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.435 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -118.53 -42.73 2.74 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.821 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.72 9.61 3.36 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.411 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.612 ' HD3' HG21 ' A' ' 45' ' ' ILE . 1.7 ttm180 -71.59 -46.28 59.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.899 0.38 . . . . 0.0 110.624 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -61.95 -27.89 69.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.887 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.474 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -74.73 -39.46 61.86 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.594 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.686 HD13 ' CZ3' ' A' ' 48' ' ' TRP . 9.8 mt -69.13 -58.49 4.0 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.525 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.847 ' OG ' HD11 ' A' ' 45' ' ' ILE . 1.7 t -40.11 -33.22 0.21 Allowed 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.271 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.4 m -77.24 -39.02 49.92 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.303 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -91.18 -9.21 46.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.629 -179.765 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.718 ' HB3' HD22 ' A' ' 40' ' ' LEU . 4.3 mm? -99.03 2.93 46.68 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.607 0.242 . . . . 0.0 111.451 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 46.84 70.14 0.74 Allowed Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.992 -0.623 . . . . 0.0 113.072 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.765 HD11 HD13 ' A' ' 45' ' ' ILE . 1.8 pt? -156.66 -151.45 0.32 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.295 0.569 . . . . 0.0 111.659 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -136.55 -89.49 0.29 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.098 -0.956 . . . . 0.0 111.615 -179.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.46 ' HA ' HG13 ' A' ' 45' ' ' ILE . 14.0 mm-40 -136.97 -46.46 0.58 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.776 0.322 . . . . 0.0 111.605 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.578 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -66.11 -19.15 65.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.751 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.806 ' HA ' HD13 ' A' ' 47' ' ' ILE . 14.8 mp0 -95.61 -17.07 21.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.973 0.416 . . . . 0.0 110.082 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.916 HD13 ' CZ2' ' A' ' 48' ' ' TRP . 8.3 mm -54.66 -49.48 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 178.016 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -66.38 -11.11 49.61 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.913 177.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.806 HD13 ' HA ' ' A' ' 44' ' ' GLN . 1.3 mp -73.67 -33.29 38.05 Favored 'Isoleucine or valine' 0 C--N 1.343 0.29 0 C-N-CA 121.034 -0.266 . . . . 0.0 111.553 -179.665 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.916 ' CZ2' HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -69.11 -60.1 2.58 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.312 179.661 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.793 ' HE2' HG22 ' A' ' 45' ' ' ILE . 1.3 m-85 -57.16 -33.27 67.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.695 -179.282 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.89 -30.15 61.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.08 0.467 . . . . 0.0 109.854 179.046 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -83.27 -30.22 27.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.997 179.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.87 -28.21 67.33 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.688 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -61.91 -32.95 73.38 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.924 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -90.73 -60.38 1.93 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.081 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.406 ' O ' ' HB ' ' A' ' 56' ' ' ILE . 2.7 mttp 63.76 26.27 14.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.133 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.406 ' HB ' ' O ' ' A' ' 55' ' ' LYS . 3.9 mt 78.94 68.76 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 121.167 0.508 . . . . 0.0 110.848 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.11 -49.2 0.15 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.852 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.99 85.19 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.872 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.4 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.914 -179.982 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 112.456 -0.258 . . . . 0.0 112.456 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -168.69 108.11 0.48 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.78 0.324 . . . . 0.0 110.886 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 63.31 47.08 4.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.786 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -170.3 47.97 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.894 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.1 mmt180 -133.11 146.91 63.11 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.95 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.546 ' HB2' HG22 ' A' ' 6' ' ' THR . 50.4 Cg_exo -54.8 -161.52 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.73 2.287 . . . . 0.0 112.48 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.6 ptp85 -127.55 43.71 3.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.544 179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.58 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -109.78 -76.59 0.61 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.978 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.58 ' H ' HG23 ' A' ' 6' ' ' THR . . . -74.21 -26.51 60.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.99 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.6 ' CD2' HD11 ' A' ' 13' ' ' LEU . 0.0 OUTLIER 170.94 113.23 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.019 0.438 . . . . 0.0 111.183 179.818 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.519 ' O ' ' CB ' ' A' ' 10' ' ' SER . 0.0 OUTLIER -95.28 38.58 1.14 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.334 -179.316 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.644 ' HA ' HD22 ' A' ' 13' ' ' LEU . 2.7 m 93.27 -31.0 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.831 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -19.83 65.45 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.173 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.449 ' HB2' ' CB ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -94.66 -44.3 7.88 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.211 179.52 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.644 HD22 ' HA ' ' A' ' 10' ' ' SER . 0.0 OUTLIER -60.76 -40.15 91.44 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.846 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.45 -21.43 37.0 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.693 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.88 -28.04 36.09 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.893 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -91.94 14.13 16.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.432 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.403 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.4 OUTLIER -137.09 0.94 2.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.397 179.957 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.0 ttp180 -145.76 -43.37 0.21 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.756 0.312 . . . . 0.0 110.686 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.64 -27.84 66.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.605 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.484 ' C ' ' CD1' ' A' ' 20' ' ' PHE . 0.8 OUTLIER -87.51 -26.7 23.05 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.788 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.449 ' O ' ' CD1' ' A' ' 25' ' ' TYR . 70.6 m-20 -73.22 -3.32 26.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.287 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -120.28 2.22 10.82 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.993 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.444 ' O ' ' CG ' ' A' ' 23' ' ' ASN . 0.2 OUTLIER -144.73 8.0 1.28 Allowed 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.89 0.376 . . . . 0.0 111.294 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.897 ' O ' HG23 ' A' ' 27' ' ' THR . 12.1 mtt180 -133.28 -55.95 0.91 Allowed 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.161 0.505 . . . . 0.0 110.69 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.485 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 1.3 p90 -37.78 -34.37 0.11 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.277 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.685 HD23 ' C ' ' A' ' 24' ' ' ARG . 2.2 pt? -51.58 -28.67 14.69 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.206 -178.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.897 HG23 ' O ' ' A' ' 24' ' ' ARG . 2.5 p -70.83 -14.96 62.6 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.972 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -136.92 15.68 3.07 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.09 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' A' ' 25' ' ' TYR . 16.4 tpt85 -121.62 -48.07 2.18 Favored 'General case' 0 C--O 1.23 0.055 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.579 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.401 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -119.91 -14.28 8.96 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.553 179.965 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.756 ' CG ' HG21 ' A' ' 45' ' ' ILE . 1.7 ttm180 -56.92 -22.49 37.96 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.672 0.273 . . . . 0.0 110.968 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -84.11 -25.17 29.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.048 0.451 . . . . 0.0 109.98 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.91 -44.09 15.77 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.044 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.858 ' O ' HD22 ' A' ' 38' ' ' LEU . 0.2 OUTLIER -64.35 -59.52 4.27 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 178.788 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.6 ' CB ' HD11 ' A' ' 45' ' ' ILE . 30.1 t -39.13 -33.04 0.11 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.374 179.292 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 12.9 m -78.88 -28.35 44.1 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.163 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 34' ' ' LEU . 3.0 tt0 -73.42 -60.63 2.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.877 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 1.091 HD23 HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -56.57 -49.77 73.88 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 121.05 0.453 . . . . 0.0 110.329 179.756 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 108.95 46.26 0.96 Allowed Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.721 -179.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 1.091 HD11 HD23 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -130.17 -160.38 1.03 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.113 0.482 . . . . 0.0 111.413 -179.322 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -118.69 -88.76 0.61 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.675 -0.693 . . . . 0.0 112.068 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.401 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 0.2 OUTLIER -141.04 -46.14 0.39 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.76 0.314 . . . . 0.0 111.1 -179.325 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.949 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -65.98 -12.89 58.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.165 179.726 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.479 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 17.4 mp0 -101.14 -20.27 15.39 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.885 HG22 ' HE2' ' A' ' 49' ' ' PHE . 41.9 mm -57.58 -60.58 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.501 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -58.02 -16.79 13.9 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.704 178.958 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.949 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -77.37 -36.08 23.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -178.303 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.858 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.8 -31.69 46.07 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 118.653 -1.219 . . . . 0.0 111.777 -179.354 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.885 ' HE2' HG22 ' A' ' 45' ' ' ILE . 4.9 m-85 -65.54 -42.49 91.88 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.064 178.319 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.465 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 6.5 pt20 -61.18 -28.4 69.11 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.741 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -85.92 -29.89 23.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.949 178.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -29.71 67.85 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.595 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.08 -30.41 17.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.869 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.81 -27.25 65.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.232 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.543 ' O ' HG22 ' A' ' 56' ' ' ILE . 0.1 OUTLIER -56.73 -28.1 60.43 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.1 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.543 HG22 ' O ' ' A' ' 55' ' ' LYS . 7.5 tt 47.16 36.14 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 CA-C-O 121.417 0.627 . . . . 0.0 110.892 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -174.1 -41.4 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.891 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 43.94 35.39 1.12 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.451 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.3 t . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.895 179.985 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.219 0 N-CA-C 112.486 -0.246 . . . . 0.0 112.486 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -154.89 96.2 1.83 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.898 0.38 . . . . 0.0 110.859 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -169.26 57.36 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.831 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -177.33 66.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.757 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.07 137.69 19.3 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.799 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -79.95 -175.88 2.94 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.595 2.197 . . . . 0.0 112.354 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.1 ttt-85 -142.72 45.38 1.6 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.061 0.458 . . . . 0.0 110.918 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.444 ' O ' ' NE2' ' A' ' 12' ' ' GLN . 5.1 m -167.19 -49.57 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.277 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.641 ' O ' ' CD1' ' A' ' 8' ' ' PHE . . . -49.72 -26.59 3.92 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.813 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.641 ' CD1' ' O ' ' A' ' 7' ' ' ALA . 2.6 m-30 145.92 118.25 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 O-C-N 124.132 0.895 . . . . 0.0 111.067 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.492 ' O ' ' CB ' ' A' ' 10' ' ' SER . 25.1 t -153.93 31.89 0.44 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.25 178.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.588 ' H ' HD21 ' A' ' 13' ' ' LEU . 5.1 t 90.39 -28.8 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.849 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -83.09 -37.37 23.91 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.503 -0.772 . . . . 0.0 111.354 -179.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -81.18 -18.48 46.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.2 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.604 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -95.91 -25.91 15.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.748 0.308 . . . . 0.0 110.522 179.553 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.59 -30.04 25.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.863 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -37.02 72.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.841 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.78 -40.86 94.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.088 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.606 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -60.14 -48.05 83.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.505 179.739 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.63 -31.95 63.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.332 179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -64.06 -46.24 85.21 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.219 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.606 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.9 OUTLIER -85.17 -23.71 28.24 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.1 -179.979 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -52.35 -25.6 10.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.954 0.407 . . . . 0.0 110.552 179.225 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -96.0 -10.84 27.55 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.3 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.83 ' HA ' HD22 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -128.67 39.29 3.83 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.851 0.358 . . . . 0.0 111.385 179.91 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.432 ' O ' HG23 ' A' ' 27' ' ' THR . 0.0 OUTLIER -124.91 -38.5 2.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.308 0.575 . . . . 0.0 111.0 -179.548 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.476 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 15.9 p90 -83.54 -40.7 18.81 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.0 -179.28 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.83 HD22 ' HA ' ' A' ' 23' ' ' ASN . 2.2 pt? -47.76 -28.22 2.4 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.357 0.598 . . . . 0.0 110.536 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.439 ' H ' HD23 ' A' ' 26' ' ' LEU . 1.2 p -58.2 -23.91 57.29 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.783 178.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -130.31 21.39 5.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.703 178.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.54 -51.24 1.38 Allowed 'General case' 0 C--O 1.231 0.087 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.94 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.515 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -131.26 4.29 4.36 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.855 -179.681 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 26' ' ' LEU . 2.9 ttt180 -58.61 -26.42 63.66 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.871 0.367 . . . . 0.0 110.667 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.94 -21.11 34.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.055 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -87.95 -37.95 15.97 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.635 -0.712 . . . . 0.0 109.52 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.837 HD22 HD21 ' A' ' 38' ' ' LEU . 0.5 OUTLIER -65.37 -49.27 69.95 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.672 178.97 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.79 ' HA ' HD11 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -47.91 -27.09 1.97 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.092 179.266 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.99 -11.9 27.66 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.601 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.403 ' N ' ' O ' ' A' ' 34' ' ' LEU . 9.6 tp10 -76.91 -62.51 1.62 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.638 0.256 . . . . 0.0 110.955 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.934 HD23 ' CD1' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -69.15 -47.63 64.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.187 0.518 . . . . 0.0 110.177 179.528 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 124.68 2.54 8.03 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.501 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.934 ' CD1' HD23 ' A' ' 38' ' ' LEU . 0.2 OUTLIER -102.15 -165.42 1.18 Allowed 'General case' 0 CA--C 1.527 0.093 0 CA-C-O 121.095 0.474 . . . . 0.0 111.396 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.545 ' O ' HG12 ' A' ' 45' ' ' ILE . 17.4 t30 -113.76 166.91 11.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.314 -179.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.56 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 91.4 mt-10 -53.07 -28.31 24.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.479 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.792 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -63.82 -48.92 74.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.982 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.509 ' HA ' ' HB ' ' A' ' 47' ' ' ILE . 13.2 mp0 -87.11 -15.09 39.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.225 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.964 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 2.5 mm -59.94 -58.62 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.538 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 0.2 OUTLIER -57.32 -18.15 15.66 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.1 178.012 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.792 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -79.39 -48.39 21.14 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 -178.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.964 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 34.0 p-90 -63.91 -25.84 68.33 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 119.392 -0.923 . . . . 0.0 112.177 -177.327 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.661 ' HE2' HG22 ' A' ' 45' ' ' ILE . 27.5 m-85 -66.33 -53.1 40.17 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 177.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.423 ' CG ' ' O ' ' A' ' 47' ' ' ILE . 1.7 pt20 -53.03 -26.49 15.86 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.252 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -87.23 -30.32 21.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.024 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.59 -28.51 63.86 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.738 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.564 ' O ' HG22 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -89.55 -29.09 19.16 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.053 179.96 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.36 -15.74 59.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.48 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -100.45 25.48 7.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.078 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 53' ' ' ARG . 6.1 tt -140.5 42.1 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.146 0.498 . . . . 0.0 111.04 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.4 mtp180 -148.31 -46.76 0.15 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.848 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -69.6 0.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.897 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.4 t . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.276 -0.869 . . . . 0.0 110.861 180.0 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -162.65 31.81 0.1 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.799 0.333 . . . . 0.0 110.906 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -160.89 55.9 0.31 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.849 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.473 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 0.1 OUTLIER -144.65 48.06 1.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.827 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.551 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 4.7 ptt-85 47.79 112.34 0.0 OUTLIER Pre-proline 0 CA--C 1.534 0.33 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.091 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.453 ' HD2' ' HB3' ' A' ' 8' ' ' PHE . 6.6 Cg_exo -74.22 -160.09 0.1 OUTLIER 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.973 2.448 . . . . 0.0 112.209 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -128.47 44.77 2.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.285 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.416 HG23 ' N ' ' A' ' 7' ' ' ALA . 5.3 t -120.48 -45.63 2.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.497 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.733 ' HB1' ' HG3' ' A' ' 12' ' ' GLN . . . -167.45 -38.15 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.08 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.984 ' CD2' HD22 ' A' ' 13' ' ' LEU . 0.6 OUTLIER -72.61 59.39 0.45 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.809 179.53 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.53 ' O ' ' CB ' ' A' ' 10' ' ' SER . 1.1 p -107.53 37.18 2.48 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.09 0.471 . . . . 0.0 110.745 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 9' ' ' SER . 4.7 m 96.92 -30.82 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.603 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -74.68 -50.41 17.69 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.193 -179.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.733 ' HG3' ' HB1' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -66.86 -19.02 65.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.398 -179.823 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.984 HD22 ' CD2' ' A' ' 8' ' ' PHE . 0.1 OUTLIER -98.42 -26.08 14.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.836 0.351 . . . . 0.0 110.479 179.792 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.72 -29.13 25.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.642 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -83.56 -35.29 24.87 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.746 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.97 -38.75 83.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.911 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.562 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.8 OUTLIER -57.67 -45.1 85.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.257 179.576 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.432 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 10.5 ttp85 -74.36 -32.67 62.85 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.528 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.49 -32.84 73.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.288 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.562 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.4 OUTLIER -105.06 -15.37 15.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.719 0.295 . . . . 0.0 111.35 -179.847 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.432 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -47.83 -34.16 8.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.905 0.383 . . . . 0.0 110.862 179.646 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.451 ' O ' ' CD2' ' A' ' 26' ' ' LEU . 15.5 mt-10 -83.59 -16.37 45.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.872 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.519 ' HA ' ' CG ' ' A' ' 26' ' ' LEU . 3.2 m120 -98.92 30.93 3.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.514 0.673 . . . . 0.0 109.784 179.411 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.6 -20.68 15.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.275 -179.059 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.514 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 12.4 p90 -116.26 -44.6 2.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.487 -178.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.521 ' HB2' ' HB3' ' A' ' 30' ' ' ARG . 0.5 OUTLIER -48.98 -27.11 2.91 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.304 0.574 . . . . 0.0 110.382 -179.811 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.419 HG23 ' H ' ' A' ' 27' ' ' THR . 0.5 OUTLIER -59.53 -24.0 63.32 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.839 178.907 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -130.93 0.29 4.25 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.996 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.85 -29.54 6.35 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.988 0.423 . . . . 0.0 110.997 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.521 ' HB3' ' HB2' ' A' ' 26' ' ' LEU . 6.6 ttm180 -115.89 -24.39 8.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.895 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.627 ' HG3' HG21 ' A' ' 45' ' ' ILE . 32.4 ttp180 -49.47 -31.57 10.25 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.188 0.518 . . . . 0.0 110.161 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -38.29 73.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.973 179.165 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.444 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.02 -37.11 47.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.94 179.219 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.852 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 4.0 mt -67.41 -41.73 84.4 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.519 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.778 ' HA ' HD11 ' A' ' 45' ' ' ILE . 3.4 t -55.66 -26.92 47.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.649 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -112.05 3.13 17.17 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.101 179.569 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.574 ' HB3' HD23 ' A' ' 38' ' ' LEU . 4.4 tt0 -85.57 -48.03 9.31 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.024 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.968 HD12 HD21 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -96.34 -31.92 12.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.797 0.332 . . . . 0.0 110.479 179.645 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 104.31 46.28 1.35 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.546 -0.835 . . . . 0.0 113.315 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.968 HD21 HD12 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -127.25 -163.95 1.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.979 0.419 . . . . 0.0 111.331 179.227 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.432 ' O ' HG12 ' A' ' 45' ' ' ILE . 1.0 OUTLIER -97.96 148.64 23.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.017 -179.176 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -53.77 -40.45 66.27 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.099 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.661 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -71.96 -31.12 65.99 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 121.755 0.788 . . . . 0.0 109.247 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.597 ' NE2' HG21 ' A' ' 47' ' ' ILE . 3.2 tm0? -77.73 -14.82 59.49 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.177 -1.374 . . . . 0.0 110.273 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.825 HD13 ' HE1' ' A' ' 48' ' ' TRP . 5.9 mm -63.29 -57.19 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.227 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.464 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -58.39 -16.53 15.14 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.917 177.795 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.661 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -79.39 -39.64 20.98 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.143 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -178.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.852 ' CZ2' HD22 ' A' ' 34' ' ' LEU . 27.1 p-90 -74.06 -27.54 60.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 118.732 -1.187 . . . . 0.0 112.319 -178.06 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.79 ' HE2' HG22 ' A' ' 45' ' ' ILE . 7.4 m-85 -68.48 -46.29 70.1 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.267 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 13.1 pt20 -60.54 -25.6 66.26 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.829 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -88.21 -31.37 19.12 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.985 178.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.53 -28.2 63.72 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.76 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.99 -39.78 14.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.929 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.423 ' HB1' HG22 ' A' ' 56' ' ' ILE . . . -72.65 -56.73 4.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.103 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.2 mttp 61.49 33.79 18.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.989 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.423 HG22 ' HB1' ' A' ' 54' ' ' ALA . 0.7 OUTLIER -140.39 42.77 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.187 0.518 . . . . 0.0 110.994 -179.948 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -122.05 -39.12 2.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.892 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.36 -31.02 63.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.994 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.201 -0.905 . . . . 0.0 110.938 179.921 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.452 -0.259 . . . . 0.0 112.452 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -122.02 177.47 5.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.812 0.339 . . . . 0.0 110.893 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 62.87 46.9 4.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.7 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.67 46.56 1.78 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.926 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.45 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 3.9 mtm-85 -106.6 130.55 22.74 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.661 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 37.1 Cg_exo -61.81 -162.49 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.397 2.064 . . . . 0.0 112.283 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.518 ' O ' ' HB ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -122.85 22.67 9.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.831 179.015 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.562 ' O ' ' HB2' ' A' ' 7' ' ' ALA . 11.0 t 176.14 -50.9 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.455 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.562 ' HB2' ' O ' ' A' ' 6' ' ' THR . . . 165.91 38.65 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.024 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.782 ' CG ' HD21 ' A' ' 13' ' ' LEU . 0.4 OUTLIER -145.89 94.33 2.47 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.783 -179.765 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.551 ' C ' ' H ' ' A' ' 11' ' ' GLU . 3.2 p -80.7 31.37 0.3 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -178.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.5 m 72.6 -26.79 0.18 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.859 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.551 ' H ' ' C ' ' A' ' 9' ' ' SER . 9.8 mt-10 -72.54 -49.26 33.91 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.564 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.471 ' HB3' ' CE1' ' A' ' 8' ' ' PHE . 0.9 OUTLIER -53.65 -29.05 36.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.32 179.397 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.782 HD21 ' CG ' ' A' ' 8' ' ' PHE . 0.6 OUTLIER -75.6 -33.71 60.56 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.073 179.386 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.88 -32.83 65.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.017 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.1 ttp180 -86.8 -29.19 22.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.438 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -79.42 -3.74 47.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.115 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.3 OUTLIER -96.75 -55.51 2.87 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.318 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.427 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 43.2 ttp85 -64.54 -30.56 71.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.898 178.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.58 -27.43 38.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.779 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.514 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 4.1 p90 -118.72 -30.52 5.09 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.399 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.427 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 0.7 OUTLIER -48.76 -28.17 3.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.785 0.326 . . . . 0.0 110.877 179.865 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.974 ' C ' HD21 ' A' ' 26' ' ' LEU . 7.4 tm-20 -108.17 22.05 16.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.951 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.66 ' HA ' HD11 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -163.73 31.38 0.08 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.27 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.514 ' HB3' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -126.75 -44.1 1.68 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.117 0.484 . . . . 0.0 110.905 -179.358 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.984 ' CE1' HD23 ' A' ' 26' ' ' LEU . 15.4 p90 -93.35 -45.94 7.58 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.096 -179.112 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.984 HD23 ' CE1' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -51.16 -27.28 8.29 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.325 0.583 . . . . 0.0 110.124 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.4 p -59.52 -21.87 60.82 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.94 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -131.37 1.32 4.14 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.712 178.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -115.91 -31.59 5.71 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 120.948 0.404 . . . . 0.0 111.009 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.441 ' HB3' ' HB2' ' A' ' 26' ' ' LEU . 4.8 ttt85 -117.57 -23.62 7.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.275 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.592 ' CG ' HG21 ' A' ' 45' ' ' ILE . 34.7 ttp180 -50.74 -30.06 12.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.045 0.45 . . . . 0.0 110.615 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.46 -31.1 62.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.338 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.471 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -75.86 -37.53 58.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.408 179.615 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.681 ' HB3' ' CH2' ' A' ' 48' ' ' TRP . 6.9 mt -68.29 -62.7 1.28 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 39.5 t -43.06 -30.17 0.41 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.196 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.6 t -79.18 -38.72 35.18 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.265 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.64 -15.81 31.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.074 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.709 ' HG ' ' CZ2' ' A' ' 48' ' ' TRP . 2.7 mm? -88.98 -27.58 20.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.631 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 58.91 65.52 3.43 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.719 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.811 HD22 ' CB ' ' A' ' 44' ' ' GLN . 0.5 OUTLIER -154.66 -164.78 1.9 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.993 0.425 . . . . 0.0 111.577 -178.889 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.428 ' O ' HG12 ' A' ' 45' ' ' ILE . 35.5 t30 -118.97 172.07 7.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.321 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.416 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 5.5 mt-10 -53.39 -23.53 9.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.678 0.275 . . . . 0.0 111.469 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.905 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -70.1 -9.45 55.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.933 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.811 ' CB ' HD22 ' A' ' 40' ' ' LEU . 17.2 mp0 -117.32 -26.65 6.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.053 0.454 . . . . 0.0 109.78 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.997 HG22 ' HE2' ' A' ' 49' ' ' PHE . 12.9 mm -57.41 -59.26 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.426 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -55.9 -25.54 43.33 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.129 179.281 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.905 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -62.89 -32.51 56.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.748 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.724 ' CZ2' HD13 ' A' ' 45' ' ' ILE . 1.1 m0 -70.89 -63.93 1.0 Allowed 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.523 0.678 . . . . 0.0 110.229 179.537 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.997 ' HE2' HG22 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -61.97 -24.22 66.88 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.82 -179.244 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.773 ' O ' ' HB2' ' A' ' 54' ' ' ALA . 7.3 mt-30 -56.88 -29.15 62.68 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -88.32 -27.78 21.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.211 179.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.91 -27.27 49.48 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.794 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.62 31.89 6.42 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.909 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.773 ' HB2' ' O ' ' A' ' 50' ' ' GLN . . . -103.79 -60.59 1.55 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.065 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.407 ' O ' ' HB ' ' A' ' 56' ' ' ILE . 18.2 mtmm -136.29 -46.92 0.63 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.951 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.407 ' HB ' ' O ' ' A' ' 55' ' ' LYS . 3.8 mt 80.17 69.12 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 121.202 0.525 . . . . 0.0 110.814 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.21 -42.31 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.934 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? 60.58 98.66 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.748 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.286 -0.864 . . . . 0.0 110.85 -179.911 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 112.596 -0.202 . . . . 0.0 112.596 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 18.9 p30 -154.75 167.69 29.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 0.0 110.875 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -158.3 51.48 0.42 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.938 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.09 66.59 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.1 ptt-85 -79.49 139.45 55.26 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.797 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -82.12 -167.18 0.45 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.618 2.212 . . . . 0.0 112.592 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.61 45.12 2.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.43 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.478 HG23 ' N ' ' A' ' 7' ' ' ALA . 7.2 t -125.03 -48.55 1.74 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.442 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.478 ' N ' HG23 ' A' ' 6' ' ' THR . . . -138.87 25.64 2.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.381 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.519 ' CE1' ' HB3' ' A' ' 13' ' ' LEU . 1.7 m-85 -145.02 72.81 1.34 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.805 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.496 ' O ' ' CB ' ' A' ' 10' ' ' SER . 0.6 OUTLIER -103.33 32.75 3.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.165 0.507 . . . . 0.0 111.208 -179.795 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.57 ' H ' HD21 ' A' ' 13' ' ' LEU . 5.5 t 89.73 -27.67 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.048 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -89.72 -9.66 48.61 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.868 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -103.91 -17.63 14.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.634 0.254 . . . . 0.0 111.383 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.57 HD21 ' H ' ' A' ' 10' ' ' SER . 0.6 OUTLIER -106.08 -22.99 12.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.006 0.432 . . . . 0.0 110.286 179.24 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.54 -17.74 57.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.665 178.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.401 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 4.5 mtt180 -61.53 -30.11 70.43 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.109 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -76.44 -1.43 27.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.835 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.481 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.2 OUTLIER -126.59 -15.58 5.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.721 -0.218 . . . . 0.0 111.401 -179.75 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.4 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 2.7 ttp180 -110.12 -37.11 5.66 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.707 0.289 . . . . 0.0 111.201 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 5.2 mm-40 -62.66 -35.14 78.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.082 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.703 ' HA ' ' OD1' ' A' ' 23' ' ' ASN . 0.5 OUTLIER -91.86 -23.12 19.76 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.904 -0.318 . . . . 0.0 110.944 179.836 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.411 ' ND2' ' O ' ' A' ' 17' ' ' LYS . 0.3 OUTLIER -55.3 -24.96 31.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.005 0.431 . . . . 0.0 110.155 179.155 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -91.6 -2.29 57.17 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.092 179.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.798 ' HB2' HD11 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -132.6 38.63 3.41 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-O 121.568 0.699 . . . . 0.0 110.677 179.4 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.482 ' O ' HG23 ' A' ' 27' ' ' THR . 0.1 OUTLIER -93.66 -48.69 6.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.175 179.722 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.511 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 10.8 p90 -70.69 -43.84 68.21 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.682 -1.144 . . . . 0.0 111.696 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.798 HD11 ' HB2' ' A' ' 23' ' ' ASN . 1.2 pp -53.87 -20.64 6.23 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.201 0.524 . . . . 0.0 110.754 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.494 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 3.3 p -65.82 -19.06 65.75 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.037 178.417 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -135.08 16.29 3.5 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.726 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.409 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -118.5 -51.41 2.4 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.639 -179.761 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.531 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -132.81 7.88 4.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.467 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.494 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 47.3 ttt180 -80.06 -2.37 44.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.903 0.382 . . . . 0.0 110.867 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -97.59 -28.91 13.73 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -69.78 -35.33 74.8 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.56 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.051 HD23 HD21 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -66.31 -63.87 0.98 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.446 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.511 ' CB ' HD11 ' A' ' 45' ' ' ILE . 17.8 t -40.3 -31.79 0.15 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.943 -1.026 . . . . 0.0 111.539 179.557 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.47 -36.98 21.91 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.946 -179.236 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -85.09 -19.37 31.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.894 0.378 . . . . 0.0 111.07 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 1.051 HD21 HD23 ' A' ' 34' ' ' LEU . 4.4 mm? -78.3 -49.98 12.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.779 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 104.48 21.22 9.45 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.718 -0.673 . . . . 0.0 111.818 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.77 HD13 HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -109.02 -160.54 0.72 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.163 0.506 . . . . 0.0 111.101 -179.847 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -120.84 -101.04 0.42 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.486 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -129.63 -42.62 1.29 Allowed 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.722 0.296 . . . . 0.0 111.516 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.918 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -73.36 -2.78 23.58 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.763 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.475 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 17.8 mp0 -106.02 -23.29 12.68 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.858 HG22 ' HE2' ' A' ' 49' ' ' PHE . 38.5 mm -56.8 -61.21 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.869 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -15.37 11.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.796 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.918 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.4 mp -79.11 -36.19 18.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -178.254 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.927 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.68 -29.65 45.74 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 118.463 -1.295 . . . . 0.0 111.902 -179.155 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.858 ' HE2' HG22 ' A' ' 45' ' ' ILE . 4.5 m-85 -69.41 -42.19 75.4 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 119.683 -0.807 . . . . 0.0 109.187 178.253 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.467 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 5.8 pt20 -60.81 -28.77 69.03 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.968 179.495 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -89.7 -28.35 19.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.056 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 33.5 tttt -78.74 -23.73 45.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.873 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -97.7 23.76 7.51 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.03 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -86.85 -43.55 12.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.118 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.419 ' O ' ' HB ' ' A' ' 56' ' ' ILE . 3.0 mptm? 62.3 33.34 16.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.873 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.419 ' HB ' ' O ' ' A' ' 55' ' ' LYS . 3.8 mt 80.81 69.32 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.873 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -117.19 -38.72 3.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.809 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -60.44 -69.71 0.21 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.822 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.3 p . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.955 -179.918 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.201 0 N-CA-C 112.488 -0.245 . . . . 0.0 112.488 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 2.3 t70 60.33 35.84 20.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.818 0.342 . . . . 0.0 110.919 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -151.95 49.95 0.79 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.912 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -160.12 56.75 0.36 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.878 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.9 mmm180 61.56 156.2 0.11 Allowed Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.73 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.21 -167.16 0.12 Allowed 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.425 2.084 . . . . 0.0 112.233 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.9 ptp180 -164.92 61.46 0.13 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.031 0.443 . . . . 0.0 110.865 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.456 ' O ' ' NE2' ' A' ' 12' ' ' GLN . 7.8 m -165.4 -48.61 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.225 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.627 ' O ' ' CD1' ' A' ' 8' ' ' PHE . . . -50.87 -26.11 5.4 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.81 179.765 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.627 ' CD1' ' O ' ' A' ' 7' ' ' ALA . 2.5 m-30 144.95 118.45 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.377 0 O-C-N 124.201 0.938 . . . . 0.0 110.99 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.498 ' O ' ' CB ' ' A' ' 10' ' ' SER . 29.5 t -158.26 32.2 0.24 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.076 0.465 . . . . 0.0 111.394 178.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.56 ' H ' HD21 ' A' ' 13' ' ' LEU . 3.1 m 90.68 -29.34 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.924 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -81.64 -37.94 26.74 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.584 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.456 ' NE2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -81.67 -19.73 41.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.321 -179.783 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.599 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -95.53 -26.65 15.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.796 0.332 . . . . 0.0 110.438 179.541 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.24 -29.48 31.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.936 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -40.72 97.5 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.018 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.31 -43.73 96.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.842 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.609 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 26.6 mtmt -63.02 -52.12 64.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.168 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 48.5 ttp85 -65.59 -31.67 72.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.547 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -65.6 -46.36 79.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.077 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.609 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.8 OUTLIER -88.22 -24.68 23.21 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.232 -179.875 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -48.45 -40.43 26.22 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.895 0.379 . . . . 0.0 110.712 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -92.21 -16.94 25.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.826 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.529 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 6.6 m-20 -103.02 32.66 3.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.311 0.577 . . . . 0.0 109.855 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.66 -40.74 2.31 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.625 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.428 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 7.9 p90 -89.91 -36.71 14.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.292 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.529 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -54.05 -11.48 0.46 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.092 0.473 . . . . 0.0 111.183 -179.889 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.469 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -81.82 -20.67 38.57 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.779 179.654 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -132.97 11.38 4.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.107 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.04 -42.11 2.04 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.809 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.408 ' HD3' ' CB ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -112.44 -14.82 13.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.362 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 ttm180 -51.78 -30.84 24.52 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.069 0.461 . . . . 0.0 110.399 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.3 -48.05 18.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.17 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -33.52 73.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.231 0.538 . . . . 0.0 109.817 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.803 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 5.1 mt -67.88 -57.27 6.52 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.515 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.46 -23.72 10.91 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.244 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.97 -27.67 23.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.387 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -111.08 29.49 7.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.785 0.326 . . . . 0.0 111.286 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.506 ' HG ' HD11 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -132.7 -56.33 0.94 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.239 0.542 . . . . 0.0 110.673 179.75 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 121.11 3.28 10.75 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.494 -0.776 . . . . 0.0 112.009 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.537 ' HB3' ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -94.22 -158.66 0.64 Allowed 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.329 0.585 . . . . 0.0 111.234 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -119.06 -59.82 1.81 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.494 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.403 ' O ' ' HB ' ' A' ' 45' ' ' ILE . 1.4 mt-10 174.72 -42.2 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.925 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -72.52 -12.04 60.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.288 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.537 ' HB2' ' HB3' ' A' ' 40' ' ' LEU . 17.6 mp0 -101.28 -15.78 17.17 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.931 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 2.7 mm -63.02 -58.74 6.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.765 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.457 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.465 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 2.6 mtmt -56.97 -19.09 16.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.047 178.028 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.925 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -78.12 -47.25 25.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 113.75 1.019 . . . . 0.0 113.75 -178.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.931 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 40.9 p-90 -65.53 -25.06 67.28 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 119.171 -1.012 . . . . 0.0 112.176 -177.549 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.683 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 23.3 m-85 -69.14 -53.96 17.4 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 176.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.559 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.4 pt20 -57.04 -28.52 62.59 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.9 179.456 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -84.66 -29.66 25.5 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.883 178.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -67.94 -29.7 68.83 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.558 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.03 30.49 6.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.83 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -106.1 -61.33 1.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.177 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.549 ' O ' HG22 ' A' ' 56' ' ' ILE . 9.4 mmpt? -76.32 -60.94 2.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.805 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.549 HG22 ' O ' ' A' ' 55' ' ' LYS . 0.6 OUTLIER 46.92 36.2 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 CA-C-O 121.484 0.659 . . . . 0.0 110.849 -179.717 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -148.2 -66.57 0.24 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.939 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 58.07 30.86 19.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.995 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.873 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.554 -0.219 . . . . 0.0 112.554 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.2 -28.2 69.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.742 0.305 . . . . 0.0 110.919 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -137.26 46.78 2.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.894 0.378 . . . . 0.0 110.839 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -173.7 64.9 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.833 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.07 136.15 62.0 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.8 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.472 ' HB3' ' CB ' ' A' ' 9' ' ' SER . 84.0 Cg_endo -86.51 -165.36 0.25 Allowed 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.737 2.291 . . . . 0.0 112.366 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.0 ptt180 -117.79 37.96 3.78 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 121.262 0.553 . . . . 0.0 110.771 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.609 ' O ' ' HB2' ' A' ' 7' ' ' ALA . 23.7 m -147.76 -62.6 0.27 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.257 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.609 ' HB2' ' O ' ' A' ' 6' ' ' THR . . . 158.08 -19.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.364 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.739 ' CG ' HD21 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -141.57 96.47 2.99 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.83 179.315 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.472 ' CB ' ' HB3' ' A' ' 4' ' ' PRO . 12.7 p -69.75 42.71 0.05 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.292 -178.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.475 ' HA ' HD12 ' A' ' 13' ' ' LEU . 5.7 t 79.8 -28.29 0.14 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.324 0.583 . . . . 0.0 110.3 -179.718 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.455 ' H ' ' C ' ' A' ' 9' ' ' SER . 3.6 tp10 -65.22 -45.75 83.44 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.672 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.491 ' CB ' ' HB3' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -68.41 -31.77 71.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.882 178.925 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.739 HD21 ' CG ' ' A' ' 8' ' ' PHE . 12.6 mt -67.84 -33.61 75.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.629 178.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.41 -33.1 60.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.926 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.43 -42.52 96.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.622 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.05 -37.34 86.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.795 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.616 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 5.1 mtmt -59.21 -46.09 89.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.241 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.4 ttp85 -70.95 -33.81 70.85 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.461 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -66.81 -49.68 65.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.887 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.619 ' HA ' ' OD1' ' A' ' 23' ' ' ASN . 0.4 OUTLIER -84.34 -15.92 44.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.013 179.876 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -48.14 -29.82 4.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.127 0.489 . . . . 0.0 109.724 178.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.436 ' O ' ' CD2' ' A' ' 26' ' ' LEU . 20.6 mt-10 -84.57 -32.33 23.86 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.313 179.05 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.619 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.8 OUTLIER -105.72 36.25 2.6 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 121.887 0.851 . . . . 0.0 109.632 178.796 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.438 ' HB2' ' CE1' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -101.95 -27.91 12.69 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.288 -1.324 . . . . 0.0 110.868 -179.982 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.513 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.0 p90 -107.45 -44.81 4.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.85 -178.417 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.549 HD21 ' HA ' ' A' ' 23' ' ' ASN . 1.1 pp -50.61 -26.21 5.09 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.237 0.541 . . . . 0.0 110.601 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.462 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 1.2 p -65.39 -19.5 65.97 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.331 -0.849 . . . . 0.0 109.768 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -133.73 7.44 3.79 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.248 178.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.428 ' N ' ' O ' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -110.81 -50.37 2.96 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.394 179.99 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.412 ' HG2' ' HB2' ' A' ' 26' ' ' LEU . 7.4 ptm180 -117.74 -9.02 10.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.207 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.492 ' HG3' HG21 ' A' ' 45' ' ' ILE . 4.5 ttp85 -54.08 -27.91 35.75 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.968 0.413 . . . . 0.0 110.589 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -82.65 -27.63 31.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.628 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -77.52 -40.1 43.84 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.921 179.054 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.867 ' O ' HD22 ' A' ' 38' ' ' LEU . 0.2 OUTLIER -64.25 -59.5 4.33 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.574 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.595 ' CB ' HD11 ' A' ' 45' ' ' ILE . 32.6 t -38.75 -32.82 0.09 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.353 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.7 m -80.49 -27.1 37.86 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.448 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.584 ' N ' ' O ' ' A' ' 34' ' ' LEU . 8.9 tm-20 -73.74 -61.26 1.9 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.884 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 1.105 HD23 HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -53.88 -53.25 55.15 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.105 0.478 . . . . 0.0 110.396 179.783 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.55 36.09 1.64 Allowed Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.595 -179.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 1.105 HD11 HD23 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -117.57 -160.53 0.78 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.144 0.497 . . . . 0.0 111.398 -179.442 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -118.62 -101.32 0.43 Allowed 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.645 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -128.14 -44.22 1.45 Allowed 'General case' 0 C--O 1.231 0.098 0 CA-C-O 120.689 0.281 . . . . 0.0 111.636 -179.237 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.925 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -72.56 -2.79 21.21 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.788 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.5 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 18.0 mp0 -106.57 -21.99 12.9 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.347 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.899 HG22 ' HE2' ' A' ' 49' ' ' PHE . 42.1 mm -58.03 -61.57 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 178.783 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.41 ' HG3' HD12 ' A' ' 47' ' ' ILE . 14.6 ptpt -57.68 -16.45 10.78 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.667 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.925 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -76.3 -39.96 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -178.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.864 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -74.23 -41.44 61.33 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 118.797 -1.161 . . . . 0.0 111.846 -179.111 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.899 ' HE2' HG22 ' A' ' 45' ' ' ILE . 2.1 m-85 -57.57 -34.3 69.06 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 119.425 -0.91 . . . . 0.0 108.968 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -50.79 -28.22 8.85 Favored 'General case' 0 C--O 1.231 0.081 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.948 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -87.44 -30.99 20.28 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.264 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.617 ' O ' HD11 ' A' ' 56' ' ' ILE . 0.1 OUTLIER -76.43 -27.81 56.38 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.712 179.656 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.1 mtp85 -108.38 29.96 6.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.841 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -93.89 -64.54 1.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.08 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.408 ' O ' ' HB ' ' A' ' 56' ' ' ILE . 4.7 mttm -142.68 -68.26 0.36 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.885 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.617 HD11 ' O ' ' A' ' 52' ' ' LYS . 3.2 mt 79.83 69.13 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 121.186 0.517 . . . . 0.0 110.77 -179.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -177.05 -47.12 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.637 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.08 69.4 0.73 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.896 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.952 179.943 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.097 0 N-CA-C 112.594 -0.202 . . . . 0.0 112.594 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -136.49 160.93 37.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.815 0.34 . . . . 0.0 110.916 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -143.95 47.39 1.43 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.77 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -156.48 50.95 0.51 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.843 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.469 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 17.8 mtt85 -134.98 116.59 12.42 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.04 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 6.3 Cg_exo -79.43 -164.09 0.26 Allowed 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.023 2.482 . . . . 0.0 112.186 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -157.02 57.59 0.52 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.554 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.516 HG23 ' N ' ' A' ' 7' ' ' ALA . 9.8 t -144.88 -50.88 0.27 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.993 0.425 . . . . 0.0 111.254 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.516 ' N ' HG23 ' A' ' 6' ' ' THR . . . -100.54 -56.36 2.36 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.744 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.791 ' CG ' HD21 ' A' ' 13' ' ' LEU . 0.0 OUTLIER 170.44 113.48 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.26 179.709 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.498 ' O ' ' CB ' ' A' ' 10' ' ' SER . 1.4 p -88.97 35.88 0.8 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -179.117 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.498 ' CB ' ' O ' ' A' ' 9' ' ' SER . 2.9 m 90.51 -30.98 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.529 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -64.1 -35.45 80.78 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.74 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.457 ' CB ' ' HB3' ' A' ' 8' ' ' PHE . 1.9 mt-30 -81.19 -28.8 34.79 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.935 179.053 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.791 HD21 ' CG ' ' A' ' 8' ' ' PHE . 10.1 mt -72.94 -37.59 67.11 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.88 179.097 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.94 -36.42 72.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.785 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -74.47 -47.86 30.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.663 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.26 -36.18 79.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.793 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.548 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 9.5 ttmt -59.91 -49.35 78.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.201 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.4 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 0.0 OUTLIER -70.48 -32.36 69.86 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.44 179.47 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.464 ' O ' ' ND2' ' A' ' 23' ' ' ASN . 3.4 mm-40 -64.95 -42.69 94.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.268 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.548 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.8 OUTLIER -94.67 -22.43 18.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.513 -179.715 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.4 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 0.4 OUTLIER -42.73 -32.4 0.59 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.782 0.325 . . . . 0.0 111.44 -179.884 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.427 ' O ' HD13 ' A' ' 26' ' ' LEU . 18.8 mt-10 -108.76 -14.65 14.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.342 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.546 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 8.3 m-20 -104.98 32.96 3.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.193 0.521 . . . . 0.0 110.231 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.424 ' HB3' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -125.23 -44.55 1.88 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.365 -178.759 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.441 ' H ' ' HD1' ' A' ' 25' ' ' TYR . 3.5 p90 -88.19 -34.17 17.9 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.135 -178.55 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.546 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER -55.26 -8.94 0.36 Allowed 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.233 -179.861 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.462 HG23 HD23 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -91.52 11.34 24.4 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.179 179.839 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.72 -42.35 0.07 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.212 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.84 -55.43 4.99 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.452 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.531 ' HD3' HD12 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -89.07 -20.63 24.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.725 179.6 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.883 ' HD2' HG21 ' A' ' 45' ' ' ILE . 0.6 OUTLIER -59.44 -43.64 93.09 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.645 179.838 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -64.69 -29.01 70.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.944 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.448 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.21 -40.02 38.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.777 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.681 HD13 ' CZ3' ' A' ' 48' ' ' TRP . 10.8 mt -70.37 -59.04 3.1 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.361 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.836 ' OG ' HD11 ' A' ' 45' ' ' ILE . 2.2 t -39.51 -33.15 0.15 Allowed 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.38 178.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.82 -38.23 46.8 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.517 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 34' ' ' LEU . 5.4 mt-10 -88.88 -18.8 26.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.51 -179.729 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.741 ' HB3' HD22 ' A' ' 40' ' ' LEU . 4.2 mm? -89.11 -1.06 57.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.63 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 48.93 69.3 1.03 Allowed Glycine 0 C--N 1.335 0.487 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.876 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.741 HD22 ' HB3' ' A' ' 38' ' ' LEU . 1.8 pt? -154.22 -150.85 0.34 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.357 0.598 . . . . 0.0 111.676 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -136.1 -89.71 0.3 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.692 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.485 ' HA ' HG13 ' A' ' 45' ' ' ILE . 2.5 tt0 -137.08 -46.9 0.58 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.798 0.332 . . . . 0.0 111.541 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.446 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -65.23 -19.61 66.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.685 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.788 ' HA ' HD13 ' A' ' 47' ' ' ILE . 14.4 mp0 -95.36 -18.57 20.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.984 0.421 . . . . 0.0 110.105 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.926 HD13 ' CZ2' ' A' ' 48' ' ' TRP . 7.7 mm -54.71 -47.47 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.047 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.455 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -68.39 -10.59 56.14 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.789 178.172 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.788 HD13 ' HA ' ' A' ' 44' ' ' GLN . 1.1 mp -73.57 -32.34 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.381 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.926 ' CZ2' HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -71.44 -54.45 10.61 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.557 179.513 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.856 ' HE2' HG22 ' A' ' 45' ' ' ILE . 1.5 m-85 -64.09 -39.12 93.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.667 -178.788 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.46 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 3.6 pt20 -58.95 -24.93 63.07 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.316 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -90.66 -30.12 17.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.471 179.308 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -81.71 -24.6 36.07 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.901 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 4.7 tpt85 -79.37 -2.59 42.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.411 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -99.23 24.44 7.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.726 0.298 . . . . 0.0 111.151 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.66 36.09 0.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.962 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.41 HG23 ' O ' ' A' ' 56' ' ' ILE . 0.7 OUTLIER -130.32 42.41 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.054 0.454 . . . . 0.0 110.947 -179.97 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 -165.52 -54.57 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.902 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.95 90.08 0.06 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.893 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.898 179.983 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 N-CA-C 112.538 -0.225 . . . . 0.0 112.538 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -134.24 113.22 11.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.848 0.356 . . . . 0.0 110.828 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 64.05 47.64 3.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.775 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.53 46.82 1.2 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.888 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.5 mtp85 -80.61 132.2 58.9 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.651 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.436 ' HB3' ' CA ' ' A' ' 9' ' ' SER . 88.1 Cg_endo -89.43 -169.23 0.36 Allowed 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 122.771 2.314 . . . . 0.0 112.643 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -114.02 35.61 4.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.265 0.555 . . . . 0.0 110.732 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.512 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.1 OUTLIER -163.63 -74.73 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.334 179.58 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.512 ' H ' HG23 ' A' ' 6' ' ' THR . . . 179.3 30.85 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.069 179.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.857 ' CD1' HD13 ' A' ' 13' ' ' LEU . 0.4 OUTLIER 173.37 116.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.197 179.781 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.461 ' O ' ' CB ' ' A' ' 10' ' ' SER . 1.3 p -80.38 38.07 0.41 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.217 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.499 ' HA ' ' CD2' ' A' ' 13' ' ' LEU . 4.9 t 83.72 -21.97 0.25 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.889 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -102.7 11.82 37.15 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.273 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.507 ' CG ' ' HB3' ' A' ' 8' ' ' PHE . 0.4 OUTLIER -122.86 -21.42 5.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.687 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.857 HD13 ' CD1' ' A' ' 8' ' ' PHE . 0.5 OUTLIER -105.54 -10.61 16.77 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.021 0.439 . . . . 0.0 110.699 178.947 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.586 ' N ' HD23 ' A' ' 13' ' ' LEU . . . -77.92 -26.31 48.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.806 179.556 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.4 mtm180 -62.35 -36.88 83.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.717 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.63 -20.87 51.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.922 179.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.643 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -105.23 -47.25 4.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.049 179.533 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.432 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 12.3 ttm180 -59.64 -30.28 68.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.542 179.294 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.5 -48.46 77.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.779 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.643 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.9 p90 -86.18 -23.89 26.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.861 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.432 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 0.9 OUTLIER -54.28 -25.46 23.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.984 0.421 . . . . 0.0 109.962 178.903 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.651 ' C ' HD21 ' A' ' 26' ' ' LEU . 30.2 mt-10 -97.04 16.33 19.91 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.757 179.207 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.567 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -159.86 37.49 0.18 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.463 179.649 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -133.69 -32.72 1.11 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.664 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.503 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 16.7 p90 -105.09 -45.38 4.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.255 -0.429 . . . . 0.0 112.151 -178.431 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.651 HD21 ' C ' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -46.34 -35.23 5.2 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.656 0.741 . . . . 0.0 109.939 -179.696 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.449 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -51.52 -25.78 7.29 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.11 178.629 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -136.05 24.61 3.3 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.326 179.356 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.22 -52.03 0.96 Allowed 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.992 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.503 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -133.06 18.24 4.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.342 179.963 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 26' ' ' LEU . 44.0 ttp85 -67.38 -41.67 84.64 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.188 0.518 . . . . 0.0 109.8 179.492 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -43.0 91.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.226 179.374 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -32.51 68.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.181 0.515 . . . . 0.0 109.912 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.8 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 5.8 mt -67.39 -57.85 5.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.338 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.4 t -51.25 -25.88 6.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.168 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.0 m -91.46 -20.34 21.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.416 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -114.34 27.77 9.24 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.812 0.339 . . . . 0.0 111.024 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.49 ' HG ' HD11 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -134.27 -59.57 0.82 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.122 0.487 . . . . 0.0 110.633 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 128.22 -6.96 6.76 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.754 -179.066 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.49 HD11 ' HG ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -91.27 -158.66 0.57 Allowed 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.288 0.566 . . . . 0.0 111.065 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -118.93 -71.67 0.73 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.262 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.405 ' HA ' HG13 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -169.68 -44.31 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.971 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -64.41 -18.58 64.84 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.999 178.447 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.444 ' HB2' ' HB3' ' A' ' 40' ' ' LEU . 24.3 mp0 -98.82 -17.71 18.31 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.817 178.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.933 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 3.5 mm -62.22 -59.29 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.567 178.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.501 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 6.6 pttt -56.68 -18.74 13.32 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.22 178.382 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.971 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -79.09 -48.84 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 -178.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.933 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 44.1 p-90 -64.39 -25.38 67.99 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 119.373 -0.931 . . . . 0.0 112.323 -177.247 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.703 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 27.0 m-85 -66.94 -52.8 38.59 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 177.205 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -56.23 -27.3 54.44 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.997 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -85.04 -31.25 23.53 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.842 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.07 -30.39 70.9 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.635 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -76.38 -30.01 57.38 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.83 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -101.42 25.78 7.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.119 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -123.18 29.86 6.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.891 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.3 tt -173.1 42.57 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.128 0.49 . . . . 0.0 110.903 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 34.0 ttt-85 -132.16 -46.14 0.92 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.861 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.19 -36.61 78.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.814 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.819 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 112.471 -0.251 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -111.03 -25.53 9.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.718 0.294 . . . . 0.0 111.142 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 65.83 48.24 1.9 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.896 0.379 . . . . 0.0 110.851 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.457 ' O ' ' CG ' ' A' ' 3' ' ' ARG . 1.5 mtpp -162.99 60.76 0.19 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.476 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.457 ' CG ' ' O ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER 58.18 138.24 0.03 OUTLIER Pre-proline 0 CA--C 1.532 0.263 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.399 -179.704 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -87.5 -166.83 0.3 Allowed 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.678 2.252 . . . . 0.0 112.632 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.4 ' HA ' ' CB ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -145.13 52.58 1.2 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.207 179.8 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.698 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -137.01 -77.4 0.41 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.004 -179.399 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.698 ' H ' HG23 ' A' ' 6' ' ' THR . . . -64.4 -33.58 76.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.624 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.867 ' CD2' HD22 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -177.41 107.72 0.06 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.138 0.494 . . . . 0.0 111.671 179.718 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.538 ' O ' ' CB ' ' A' ' 10' ' ' SER . 0.2 OUTLIER -101.31 40.3 1.31 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.335 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.841 ' H ' HD21 ' A' ' 13' ' ' LEU . 4.7 m 96.64 -30.14 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.008 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -77.02 -18.95 57.8 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.761 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.516 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 0.3 OUTLIER -98.16 1.4 47.43 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.883 0.373 . . . . 0.0 111.413 179.886 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.892 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -119.79 -29.93 4.89 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.292 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.74 -26.46 54.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.063 178.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.41 -27.71 12.65 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.819 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.516 ' HB3' ' O ' ' A' ' 12' ' ' GLN . . . -86.35 -10.21 54.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.589 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.59 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 31.3 ttmt -110.59 -35.41 6.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.988 0.423 . . . . 0.0 110.185 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.461 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 0.0 OUTLIER -75.11 -31.7 61.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.63 179.538 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.23 -43.22 99.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.112 -179.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.59 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.4 p90 -91.85 -22.5 20.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.203 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.461 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 1.3 m-80 -53.08 -29.22 29.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.064 0.459 . . . . 0.0 109.913 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -86.84 -13.28 45.42 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.721 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.826 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -127.81 41.16 3.56 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.604 0.716 . . . . 0.0 110.361 179.181 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.411 ' HG3' ' N ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -99.5 -43.25 6.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.422 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.52 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 12.4 p90 -79.75 -44.25 21.07 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.656 -1.157 . . . . 0.0 111.79 -179.042 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.826 HD21 ' HA ' ' A' ' 23' ' ' ASN . 0.5 OUTLIER -50.05 -27.62 5.86 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.342 0.592 . . . . 0.0 110.319 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.475 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 2.3 p -61.37 -20.24 62.79 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.725 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -136.37 12.35 3.26 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.521 179.05 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.84 -29.97 4.21 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.042 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.451 ' HG3' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -146.64 20.25 1.32 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.784 179.886 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.475 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 2.3 ttt180 -88.57 -44.0 10.97 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 121.044 0.449 . . . . 0.0 109.813 179.35 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 -59.75 -28.85 67.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.817 -0.628 . . . . 0.0 109.799 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.511 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -67.73 -34.87 77.69 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.271 179.421 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.006 HD23 HD21 ' A' ' 38' ' ' LEU . 0.9 OUTLIER -71.97 -61.41 1.8 Allowed 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.431 179.295 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.48 ' HA ' HD12 ' A' ' 40' ' ' LEU . 10.7 t -44.72 -29.5 0.78 Allowed 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.878 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.52 -26.43 18.78 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.179 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 34' ' ' LEU . 4.3 tt0 -106.04 20.11 19.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.786 0.327 . . . . 0.0 110.88 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 1.006 HD21 HD23 ' A' ' 34' ' ' LEU . 2.7 mm? -118.72 -43.43 2.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.39 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 99.31 34.87 4.92 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.669 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.822 HD13 HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -123.93 -159.6 0.87 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.23 0.538 . . . . 0.0 111.646 -179.378 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.51 -84.82 0.65 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.794 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -147.07 -46.9 0.18 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.859 0.361 . . . . 0.0 110.681 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.987 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -67.6 -11.68 58.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.265 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.48 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 20.8 mp0 -97.65 -19.89 17.98 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.004 0.43 . . . . 0.0 109.969 179.222 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.822 HD13 HD13 ' A' ' 40' ' ' LEU . 44.8 mm -56.69 -61.39 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.668 178.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -59.58 -14.76 14.59 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.822 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.987 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -77.73 -37.58 24.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -178.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.826 ' CZ3' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -76.52 -33.41 58.6 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 118.505 -1.278 . . . . 0.0 111.975 -179.154 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.789 ' CZ ' ' CZ3' ' A' ' 48' ' ' TRP . 5.4 m-85 -66.94 -42.68 84.88 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 119.675 -0.81 . . . . 0.0 109.09 178.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.526 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 6.3 pt20 -62.84 -31.27 72.25 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -80.43 -31.71 37.47 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.642 178.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.5 mtmm -62.28 -29.36 70.37 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.453 179.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.31 26.6 7.57 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.829 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -97.69 23.42 7.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.186 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -159.01 29.61 0.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.772 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -164.45 42.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.211 0.529 . . . . 0.0 110.865 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.79 -46.82 0.11 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.787 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -59.34 -38.36 80.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.901 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.9 m . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.922 179.928 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 N-CA-C 112.479 -0.248 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -83.09 172.29 12.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.859 0.361 . . . . 0.0 110.882 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 63.52 47.4 3.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.814 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.6 mtpt -141.17 48.42 1.68 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.96 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.413 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 20.4 mtt180 -137.2 139.36 27.87 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.981 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.445 ' HB3' ' N ' ' A' ' 9' ' ' SER . 51.5 Cg_exo -56.11 -161.36 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.616 2.211 . . . . 0.0 112.404 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -112.3 30.38 7.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.088 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.594 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -176.95 -71.03 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.054 179.562 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.594 ' H ' HG23 ' A' ' 6' ' ' THR . . . -173.11 33.27 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.269 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.568 ' CD1' HD11 ' A' ' 13' ' ' LEU . 0.0 OUTLIER 158.25 122.72 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.995 -1.002 . . . . 0.0 108.902 -179.577 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.445 ' N ' ' HB3' ' A' ' 4' ' ' PRO . 3.9 p -66.72 158.1 31.05 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.383 -179.459 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.552 ' HA ' HD22 ' A' ' 13' ' ' LEU . 37.0 m -47.89 -31.23 4.88 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.209 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -53.76 -30.85 46.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.805 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.473 ' CB ' ' HB2' ' A' ' 8' ' ' PHE . 5.9 mm-40 -83.38 -45.06 14.15 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.13 179.08 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.608 HD13 ' N ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -64.72 -30.31 71.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.741 179.082 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.76 -18.1 45.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.737 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -52.46 36.47 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.577 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.26 -33.65 72.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.052 0.453 . . . . 0.0 110.582 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.637 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.9 OUTLIER -66.77 -54.41 23.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.2 179.491 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -61.49 -29.94 70.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.421 179.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.81 -50.62 62.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.875 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.637 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.9 OUTLIER -82.38 -24.55 34.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.888 179.853 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -54.11 -25.97 24.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.118 0.485 . . . . 0.0 109.831 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.601 ' C ' HD21 ' A' ' 26' ' ' LEU . 0.2 OUTLIER -97.52 19.28 13.67 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.662 179.201 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.771 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -163.02 37.38 0.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.145 0.497 . . . . 0.0 110.762 179.618 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.14 -38.34 1.23 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.12 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.557 ' CE1' HD23 ' A' ' 26' ' ' LEU . 19.6 p90 -94.27 -44.98 7.7 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.596 -178.654 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.771 HD21 ' HA ' ' A' ' 23' ' ' ASN . 0.3 OUTLIER -49.29 -29.64 6.25 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.358 0.599 . . . . 0.0 110.102 -179.564 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.412 ' H ' HG23 ' A' ' 27' ' ' THR . 1.2 p -57.79 -22.04 45.06 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.114 178.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -133.42 10.18 4.06 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.611 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -123.79 -40.65 2.3 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-O 120.969 0.414 . . . . 0.0 110.921 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.57 -12.51 10.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.085 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.683 ' CD ' HG21 ' A' ' 45' ' ' ILE . 3.6 ttt180 -56.96 -23.74 47.91 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.848 0.356 . . . . 0.0 110.81 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.01 -19.37 40.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.281 179.46 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.51 -46.24 11.04 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.27 179.488 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.893 HD22 ' CH2' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -63.51 -59.14 5.03 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.914 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.604 ' CB ' HD11 ' A' ' 45' ' ' ILE . 29.5 t -39.38 -32.76 0.13 Allowed 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.356 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.5 -27.82 41.44 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.194 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 34' ' ' LEU . 0.6 OUTLIER -73.39 -60.84 2.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.889 179.899 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 1.159 HD23 HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -56.29 -53.44 57.21 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.099 0.476 . . . . 0.0 110.41 179.846 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 114.12 43.15 0.8 Allowed Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.723 -179.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 1.159 HD11 HD23 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -129.63 -160.93 1.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.992 0.425 . . . . 0.0 111.398 -179.383 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.43 ' OD1' ' N ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -119.46 -91.58 0.55 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.16 -179.299 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.419 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 1.2 mp0 -136.77 -45.7 0.59 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.765 0.317 . . . . 0.0 111.333 -179.165 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.961 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -66.36 -11.76 52.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.265 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.492 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 16.9 mp0 -103.39 -21.33 13.82 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.904 HG22 ' HE2' ' A' ' 49' ' ' PHE . 42.5 mm -57.41 -61.14 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.492 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.473 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 9.4 ttmt -57.56 -17.0 11.73 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.757 178.785 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.961 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -77.3 -34.83 21.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 -178.257 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.893 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -79.83 -32.4 40.62 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 118.685 -1.206 . . . . 0.0 111.611 -179.488 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.904 ' HE2' HG22 ' A' ' 45' ' ' ILE . 3.7 m-85 -65.71 -41.49 92.24 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 119.655 -0.818 . . . . 0.0 109.179 178.398 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.593 ' O ' ' HB2' ' A' ' 54' ' ' ALA . 5.1 pt20 -61.36 -26.33 67.75 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 121.075 0.464 . . . . 0.0 109.805 179.25 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -88.89 -30.66 18.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.924 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.4 -27.88 61.7 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.634 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.16 37.96 2.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.813 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.593 ' HB2' ' O ' ' A' ' 50' ' ' GLN . . . -59.3 -37.71 78.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.173 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.17 31.11 19.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.523 HG22 ' HB1' ' A' ' 54' ' ' ALA . 0.6 OUTLIER -135.55 42.87 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.204 0.526 . . . . 0.0 110.99 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.6 mmt180 -129.74 -35.21 1.69 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.745 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.17 52.74 2.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.968 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.973 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.16 0 N-CA-C 112.514 -0.234 . . . . 0.0 112.514 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -168.46 -174.39 2.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.786 0.327 . . . . 0.0 110.915 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 64.3 47.68 3.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.866 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -146.91 47.5 1.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.915 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.491 ' O ' HG23 ' A' ' 6' ' ' THR . 51.6 mtt85 -135.66 152.66 76.57 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.827 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.779 ' O ' HG22 ' A' ' 6' ' ' THR . 61.2 Cg_endo -73.11 160.11 46.18 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.532 2.155 . . . . 0.0 112.193 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 62.3 mtt85 56.26 42.51 27.85 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.483 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.779 HG22 ' O ' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -177.9 -70.37 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.349 -179.587 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.658 ' H ' HG23 ' A' ' 6' ' ' THR . . . -83.57 -27.18 29.45 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.703 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.971 ' CD2' HD22 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -174.86 105.34 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.035 179.683 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.557 ' O ' ' CB ' ' A' ' 10' ' ' SER . 0.7 OUTLIER -100.11 42.78 1.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.031 -179.045 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.811 ' H ' HD21 ' A' ' 13' ' ' LEU . 5.1 t 93.37 -26.03 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.797 179.115 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -91.05 9.8 29.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.927 -178.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.56 ' HG2' ' HB3' ' A' ' 8' ' ' PHE . 10.4 tp60 -126.55 -9.26 6.24 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.893 0.378 . . . . 0.0 110.835 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.971 HD22 ' CD2' ' A' ' 8' ' ' PHE . 0.2 OUTLIER -115.11 -24.45 8.53 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.293 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.9 -20.85 62.68 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.946 178.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -69.21 -29.68 67.69 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.562 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.412 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . . . -61.29 -34.0 74.49 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.942 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.636 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 18.9 mttt -58.08 -42.92 86.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.595 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 1.5 ttm-85 -78.26 -32.5 49.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.354 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.412 ' HB2' ' HA ' ' A' ' 16' ' ' ALA . 0.3 OUTLIER -69.39 -42.73 74.74 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.287 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.636 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.4 OUTLIER -86.42 -22.05 26.78 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.22 -179.642 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -48.09 -53.32 16.92 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.834 0.35 . . . . 0.0 110.818 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -78.7 -13.51 59.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.048 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.55 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 5.6 m-20 -103.19 32.47 3.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.248 0.547 . . . . 0.0 109.803 179.701 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.45 -38.12 2.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.745 -178.441 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.429 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 8.8 p90 -92.68 -36.99 12.64 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.397 -178.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.55 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -53.94 -9.98 0.29 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.331 -179.944 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.527 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.5 OUTLIER -83.16 -22.69 33.2 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.649 179.617 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -133.09 16.04 4.18 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.069 178.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.0 tpt180 -121.26 -55.97 1.93 Allowed 'General case' 0 C--O 1.231 0.099 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.503 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.424 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -120.07 4.1 10.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.135 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.527 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.3 OUTLIER -56.86 -28.37 61.65 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 121.009 0.433 . . . . 0.0 110.318 179.454 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -79.13 -20.41 48.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.171 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.23 -44.99 11.04 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.663 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.831 HD22 HD21 ' A' ' 38' ' ' LEU . 0.6 OUTLIER -57.77 -45.82 85.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.787 179.107 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.557 ' HA ' HD11 ' A' ' 45' ' ' ILE . 1.8 t -48.01 -26.64 1.86 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.093 179.405 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.47 -10.58 21.99 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.509 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -76.3 -61.83 1.82 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.745 0.307 . . . . 0.0 111.062 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.931 HD23 ' CD1' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -71.36 -47.27 57.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.117 0.484 . . . . 0.0 110.239 179.66 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 123.35 4.47 8.3 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.465 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.931 ' CD1' HD23 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -106.71 -167.99 1.36 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.955 0.407 . . . . 0.0 111.208 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.611 ' O ' HG12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -113.8 171.62 7.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.894 -179.888 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.47 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 49.5 mt-10 -52.78 -39.0 61.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.575 -179.124 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.931 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -56.72 -23.5 42.86 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.316 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.548 ' HA ' ' HB ' ' A' ' 47' ' ' ILE . 16.9 mp0 -107.66 -21.77 12.75 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.666 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.935 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 10.8 mm -57.32 -57.79 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.28 179.148 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.444 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -59.84 -20.05 54.65 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.151 178.093 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.931 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.4 mp -79.2 -46.73 23.22 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -178.375 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.935 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 25.2 p-90 -66.54 -30.17 70.42 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 119.003 -1.079 . . . . 0.0 111.958 -177.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.747 ' HE2' HG22 ' A' ' 45' ' ' ILE . 21.5 m-85 -64.17 -53.52 48.09 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 177.083 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.839 ' O ' ' HB2' ' A' ' 54' ' ' ALA . 10.4 pt20 -56.72 -25.65 55.0 Favored 'General case' 0 N--CA 1.457 -0.087 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.109 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.2 m-20 -86.09 -30.77 22.32 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.216 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.13 -9.28 59.83 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.095 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.32 48.02 1.67 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.0 0.428 . . . . 0.0 110.816 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.839 ' HB2' ' O ' ' A' ' 50' ' ' GLN . . . -119.82 -64.41 1.27 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.171 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.01 33.25 17.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.585 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.484 ' O ' HG22 ' A' ' 56' ' ' ILE . 30.7 mt -155.57 60.54 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.528 0.68 . . . . 0.0 110.72 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.9 mtt180 -145.98 -46.85 0.2 Allowed 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.77 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.5 mpt_? -54.76 -30.91 57.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.968 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.895 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -96.96 40.44 1.14 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.832 0.349 . . . . 0.0 110.919 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 61.87 46.11 7.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.772 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.26 46.03 1.42 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.742 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.0 mtt180 179.57 162.16 0.8 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.636 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -76.62 -165.44 0.32 Allowed 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.473 2.116 . . . . 0.0 112.167 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -106.85 31.82 5.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.267 0.556 . . . . 0.0 111.196 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.602 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -178.46 -69.59 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.801 179.578 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.602 ' H ' HG23 ' A' ' 6' ' ' THR . . . -159.52 -42.89 0.05 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.954 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.688 ' HD2' HD22 ' A' ' 13' ' ' LEU . 1.2 p90 -150.78 96.33 2.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.729 178.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.442 ' O ' ' CB ' ' A' ' 10' ' ' SER . 37.6 m -133.33 23.41 4.09 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.635 -0.426 . . . . 0.0 112.097 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.442 ' CB ' ' O ' ' A' ' 9' ' ' SER . 0.7 OUTLIER 164.67 -59.65 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 178.351 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -69.2 -22.84 63.87 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -178.156 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.792 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 2.3 mp0 -100.2 -8.36 23.65 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.782 0.325 . . . . 0.0 111.14 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.965 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -115.39 -2.8 12.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.037 179.31 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -106.64 -28.52 10.17 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.8 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.418 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 5.9 mtp180 -112.82 -16.45 12.73 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.71 -179.6 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.792 ' HB3' ' O ' ' A' ' 12' ' ' GLN . . . -95.61 22.48 7.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.804 0.335 . . . . 0.0 111.183 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.459 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -165.15 21.29 0.05 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.367 -179.707 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.53 ' HA ' ' ND2' ' A' ' 21' ' ' ASN . 0.0 OUTLIER -165.26 -51.35 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.737 0.303 . . . . 0.0 111.252 -179.895 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.418 ' HB2' ' HA ' ' A' ' 15' ' ' ARG . 2.4 mm-40 -71.32 -25.34 62.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.204 -179.675 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.52 ' C ' ' CD1' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -76.65 -28.06 55.87 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.063 -179.914 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.53 ' ND2' ' HA ' ' A' ' 18' ' ' ARG . 3.7 p30 -78.86 7.79 6.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.773 0.32 . . . . 0.0 111.165 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.453 ' HA ' ' CE1' ' A' ' 25' ' ' TYR . 30.2 mm-40 -128.76 5.64 5.53 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.413 179.376 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.476 ' O ' ' CG ' ' A' ' 23' ' ' ASN . 0.9 OUTLIER -152.48 13.09 0.55 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.039 -179.13 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.972 ' O ' HG23 ' A' ' 27' ' ' THR . 0.0 OUTLIER -138.22 -59.29 0.64 Allowed 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.354 0.597 . . . . 0.0 110.575 179.792 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.501 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 1.6 p90 -45.6 -29.87 1.33 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.013 179.322 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.56 HD23 ' C ' ' A' ' 24' ' ' ARG . 2.6 pt? -57.26 -10.8 1.41 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.76 -178.711 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.972 HG23 ' O ' ' A' ' 24' ' ' ARG . 1.3 p -93.51 -5.77 48.32 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.301 0.572 . . . . 0.0 109.63 179.486 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -148.51 22.35 1.03 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.015 179.066 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.408 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -151.59 -39.09 0.12 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.214 -179.524 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.417 ' H ' ' HA ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -128.9 32.2 4.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.024 179.645 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.556 ' HB3' ' HA ' ' A' ' 27' ' ' THR . 0.0 OUTLIER -96.58 -25.38 15.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.759 -179.7 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -99.62 -8.22 24.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.131 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.99 -38.68 8.49 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 178.663 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.994 HD21 ' CZ2' ' A' ' 48' ' ' TRP . 3.6 tt -68.01 -52.72 32.42 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.271 -1.331 . . . . 0.0 109.254 178.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.578 ' HA ' HD11 ' A' ' 38' ' ' LEU . 10.7 t -58.75 -20.71 51.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.443 179.066 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 75.2 m -91.1 -16.84 27.16 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.47 ' HG3' ' HG ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -100.82 23.56 10.42 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.381 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.892 HD13 HD12 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -166.94 16.39 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.617 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 45.59 32.89 4.33 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.025 -0.607 . . . . 0.0 113.351 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.933 HD13 ' CE2' ' A' ' 48' ' ' TRP . 11.6 mt -99.87 142.94 30.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.86 0.362 . . . . 0.0 110.43 179.578 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.473 ' O ' HG12 ' A' ' 45' ' ' ILE . 0.7 OUTLIER -68.41 141.14 55.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.247 -179.541 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.99 -33.76 18.89 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 121.184 0.516 . . . . 0.0 110.428 179.789 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.841 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -80.46 -33.01 37.03 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.778 0.799 . . . . 0.0 109.739 178.704 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.482 ' OE1' HD22 ' A' ' 40' ' ' LEU . 1.9 tm0? -77.44 -16.38 58.82 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.457 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.783 HG22 ' HE2' ' A' ' 49' ' ' PHE . 16.7 mm -62.43 -49.28 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.003 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 22.3 mtmt -70.86 -4.39 24.05 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.946 178.209 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.841 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.5 mp -86.45 -32.92 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -178.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.994 ' CZ2' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.81 -44.99 21.89 Favored 'General case' 0 N--CA 1.461 0.078 0 C-N-CA 118.113 -1.435 . . . . 0.0 111.141 179.689 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.783 ' HE2' HG22 ' A' ' 45' ' ' ILE . 6.0 m-85 -55.52 -43.86 76.13 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 120.104 -0.638 . . . . 0.0 109.625 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.49 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 4.6 pt20 -61.47 -24.77 66.8 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.177 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -90.25 -30.94 17.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.355 179.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.76 -29.04 44.89 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.695 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.41 25.95 7.76 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.849 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -93.54 -21.83 19.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.332 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 66.88 48.08 1.37 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.94 0.4 . . . . 0.0 110.843 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.1 tt -128.19 42.15 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.999 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -145.12 -68.7 0.3 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.769 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 40.7 46.0 2.16 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.648 179.833 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 26.3 p . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.875 -179.976 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 112.539 -0.224 . . . . 0.0 112.539 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -175.39 139.16 0.43 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.821 0.343 . . . . 0.0 110.921 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -177.02 43.0 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.901 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.21 45.79 8.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.844 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.93 133.84 21.52 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.898 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -84.92 -168.08 0.48 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.658 2.239 . . . . 0.0 112.408 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 18.2 mtt85 -141.51 47.01 1.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.779 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.522 HG23 ' N ' ' A' ' 7' ' ' ALA . 3.3 t -144.81 -51.33 0.28 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.832 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.522 ' N ' HG23 ' A' ' 6' ' ' THR . . . -64.02 -27.96 69.47 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.829 ' CD2' HD22 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -178.8 107.73 0.04 OUTLIER 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.942 179.039 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.546 ' O ' ' CB ' ' A' ' 10' ' ' SER . 92.2 p -102.77 42.47 1.15 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.519 -179.6 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.875 ' H ' HD21 ' A' ' 13' ' ' LEU . 5.1 m 97.19 -30.23 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.074 179.615 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -76.68 -20.71 56.31 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.875 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.05 1.58 47.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.834 0.35 . . . . 0.0 111.426 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.905 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -120.56 -29.22 4.78 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.191 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.26 -29.47 53.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.077 178.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.65 -25.08 16.9 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.736 179.582 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -87.05 -9.08 56.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.189 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.65 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 33.2 mttm -106.48 -46.07 4.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.057 0.456 . . . . 0.0 110.038 179.548 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.413 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 8.1 ttp180 -61.77 -29.89 70.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.399 179.186 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -63.49 -50.02 71.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.808 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.65 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.4 p90 -83.66 -25.7 30.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.063 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.436 ' O ' ' CD1' ' A' ' 25' ' ' TYR . 1.3 m-80 -52.93 -20.83 3.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.801 0.334 . . . . 0.0 110.317 178.745 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.57 14.96 25.23 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.55 179.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.549 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -153.76 31.11 0.46 Allowed 'General case' 0 N--CA 1.461 0.124 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.677 ' O ' HG23 ' A' ' 27' ' ' THR . 0.5 OUTLIER -146.92 -46.01 0.18 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.761 0.791 . . . . 0.0 109.925 179.521 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.487 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 4.2 p90 -54.78 -38.2 66.97 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.596 -1.184 . . . . 0.0 110.337 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.51 HD23 ' H ' ' A' ' 26' ' ' LEU . 1.9 pt? -53.15 -26.77 18.16 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.696 -179.301 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.677 HG23 ' O ' ' A' ' 24' ' ' ARG . 6.6 p -67.01 -17.68 65.03 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.418 178.749 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -135.75 19.07 3.28 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.783 178.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.46 -46.71 1.75 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.664 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.412 ' HG3' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -135.8 11.33 3.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.499 179.993 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.475 ' N ' ' O ' ' A' ' 26' ' ' LEU . 1.4 ttm180 -64.66 -34.65 78.79 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.124 0.488 . . . . 0.0 110.111 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -76.91 -10.2 59.21 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.962 179.052 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.452 ' NE2' ' OE1' ' A' ' 37' ' ' GLU . 1.5 tm0? -102.85 -15.24 16.28 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.817 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.785 ' O ' HD13 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -102.0 -3.1 28.26 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.47 179.513 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.654 ' HA ' HD11 ' A' ' 45' ' ' ILE . 3.1 t -112.79 -3.18 14.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.637 179.603 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -116.27 -23.21 8.49 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.237 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.544 ' C ' HD12 ' A' ' 38' ' ' LEU . 0.7 OUTLIER -91.3 15.52 11.86 Favored 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 111.736 0.272 . . . . 0.0 111.736 -179.72 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.831 ' N ' HD12 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -158.89 23.11 0.21 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.721 0.296 . . . . 0.0 111.224 -179.08 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 53.2 22.61 14.63 Favored Glycine 0 CA--C 1.518 0.254 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.941 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.746 HD12 HD13 ' A' ' 38' ' ' LEU . 6.4 mt -89.75 -171.39 3.16 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.008 0.432 . . . . 0.0 110.828 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.524 ' O ' HG12 ' A' ' 45' ' ' ILE . 1.7 t30 -133.47 140.29 47.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.418 178.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -46.97 -27.97 1.47 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.086 0.47 . . . . 0.0 110.948 -179.553 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.586 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -78.85 -40.42 32.71 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.461 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.597 ' HA ' HD13 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -84.64 -11.8 55.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.353 -179.473 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.845 HG22 ' CE2' ' A' ' 49' ' ' PHE . 20.4 mm -55.77 -52.96 42.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.639 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.552 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 38.4 mtmt -63.3 -16.26 59.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.248 177.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.597 HD13 ' HA ' ' A' ' 44' ' ' GLN . 1.3 mp -79.94 -44.4 22.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -178.477 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.755 ' CZ2' HD22 ' A' ' 34' ' ' LEU . 13.3 p-90 -71.36 -27.38 63.31 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 118.645 -1.222 . . . . 0.0 111.95 -178.284 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.845 ' CE2' HG22 ' A' ' 45' ' ' ILE . 23.0 m-85 -66.25 -51.07 61.16 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 177.01 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.492 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.3 pt20 -58.05 -25.84 61.72 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.021 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -87.24 -30.7 20.74 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.017 179.013 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.1 mmtp -70.59 -29.19 65.54 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.678 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -118.06 31.61 6.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.847 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.438 ' HB2' ' O ' ' A' ' 50' ' ' GLN . . . -83.06 -46.1 13.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.048 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.95 48.28 3.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.816 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -128.01 42.36 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.934 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -121.01 -34.27 3.56 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.918 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.62 -5.33 47.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.445 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 23.8 p . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.185 -0.912 . . . . 0.0 111.109 -179.984 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.524 -0.231 . . . . 0.0 112.524 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -89.09 -59.53 2.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.796 0.332 . . . . 0.0 110.887 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -176.2 54.58 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.835 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.85 49.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.929 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.2 132.62 21.99 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.919 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -85.85 -175.25 1.8 Allowed 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.721 2.281 . . . . 0.0 112.152 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.453 ' O ' ' HB ' ' A' ' 6' ' ' THR . 31.6 mtt180 -109.04 27.39 9.55 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.417 0.627 . . . . 0.0 111.106 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.524 ' O ' ' HB2' ' A' ' 7' ' ' ALA . 3.1 t 178.43 -40.59 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.126 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.524 ' HB2' ' O ' ' A' ' 6' ' ' THR . . . 165.81 -26.25 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.851 -179.715 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.948 ' CD2' HD22 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -152.0 92.75 1.76 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.97 179.407 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.551 ' O ' ' CB ' ' A' ' 10' ' ' SER . 1.2 m -88.48 40.35 0.96 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.778 -179.052 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.809 ' H ' HD21 ' A' ' 13' ' ' LEU . 4.6 t 95.22 -29.73 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.03 179.594 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -75.61 -15.95 60.28 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.531 -179.574 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.06 -0.35 33.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.891 0.376 . . . . 0.0 111.484 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.948 HD22 ' CD2' ' A' ' 8' ' ' PHE . 0.1 OUTLIER -122.41 -31.65 3.75 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.338 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.7 -26.15 63.29 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.198 178.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -76.03 -38.35 57.33 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.48 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -74.18 -39.99 62.83 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.241 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.683 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 14.7 mttm -63.43 -43.91 96.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.211 179.255 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -74.18 -31.44 62.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.156 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -66.15 -46.65 76.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.824 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.683 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.6 OUTLIER -83.25 -25.71 31.4 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.862 179.885 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -51.24 -30.33 17.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.04 0.448 . . . . 0.0 110.344 179.404 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.534 ' O ' ' ND2' ' A' ' 23' ' ' ASN . 38.5 mt-10 -118.25 13.66 13.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.613 179.276 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.742 ' HA ' HD21 ' A' ' 26' ' ' LEU . 9.6 m120 -139.92 50.37 1.74 Allowed 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.314 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.1 ttm180 -138.29 -34.02 0.66 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 -177.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.591 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 13.3 p90 -110.47 -50.25 2.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.724 0.297 . . . . 0.0 111.368 -178.703 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.742 HD21 ' HA ' ' A' ' 23' ' ' ASN . 1.4 pt? -45.64 -34.61 3.55 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.364 0.602 . . . . 0.0 110.005 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.44 ' HB ' ' NH1' ' A' ' 31' ' ' ARG . 1.1 p -52.07 -25.69 9.27 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.884 178.737 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -132.1 27.94 4.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.878 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.99 -46.28 0.35 Allowed 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.016 -179.357 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.517 ' HG2' ' O ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -113.14 -18.27 12.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.011 -179.627 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.44 ' NH1' ' HB ' ' A' ' 27' ' ' THR . 5.6 ttm180 -50.46 -30.97 13.91 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.049 0.452 . . . . 0.0 110.553 179.656 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -72.95 -35.12 66.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.192 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.472 ' HG3' ' HG2' ' A' ' 30' ' ' ARG . 0.5 OUTLIER -74.29 -37.63 63.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.021 179.34 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.894 ' O ' HD22 ' A' ' 38' ' ' LEU . 5.8 mt -64.22 -50.09 69.39 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.928 179.267 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.7 t -45.69 -28.7 1.06 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.263 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -97.22 -14.1 21.62 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.74 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.505 ' HB3' HD13 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -84.66 -66.56 0.88 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.6 0.238 . . . . 0.0 111.258 -179.713 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.916 HD23 ' CD1' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -60.25 -50.12 74.93 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.033 0.444 . . . . 0.0 110.65 -179.919 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 127.5 -1.93 7.04 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.359 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.916 ' CD1' HD23 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -96.48 -161.75 0.9 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.913 0.387 . . . . 0.0 110.944 179.867 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -112.26 -100.75 0.41 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.519 -179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -133.21 -47.45 0.84 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.779 0.323 . . . . 0.0 110.916 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.991 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -60.97 -14.79 25.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.894 179.336 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.443 ' HA ' ' HB ' ' A' ' 47' ' ' ILE . 15.9 mp0 -102.32 -20.65 14.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.885 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 8.4 mm -60.42 -59.61 3.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.635 178.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.454 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 15.9 mtmt -58.11 -17.82 20.91 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.26 178.268 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.991 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.4 mp -80.26 -43.21 21.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -178.409 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.885 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 32.4 p-90 -70.72 -26.95 63.63 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 118.904 -1.119 . . . . 0.0 112.197 -177.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.764 ' HE2' HG22 ' A' ' 45' ' ' ILE . 10.8 m-85 -67.97 -49.33 62.34 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.184 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.9 pt20 -59.35 -25.67 64.42 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.996 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -89.04 -29.4 19.48 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.946 178.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -73.78 -28.84 61.86 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.683 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -101.97 26.29 7.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.873 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -84.77 -28.71 26.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.102 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp 62.66 35.03 14.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.827 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -175.95 42.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.123 0.487 . . . . 0.0 110.944 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.77 -68.01 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.814 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.29 84.96 0.11 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.899 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.7 p . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.165 -0.921 . . . . 0.0 110.93 -179.995 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -135.93 -45.94 0.65 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.889 0.376 . . . . 0.0 110.996 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 65.4 47.23 2.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.795 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.9 tttm -176.41 53.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.863 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.453 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -129.12 120.13 20.04 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.958 179.985 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.492 ' HB3' ' N ' ' A' ' 9' ' ' SER . 25.0 Cg_exo -64.26 -161.39 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.698 2.265 . . . . 0.0 112.293 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 8.8 mtt-85 -117.66 31.23 6.83 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.004 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.6 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -175.11 -70.92 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.481 179.489 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.6 ' H ' HG23 ' A' ' 6' ' ' THR . . . -173.7 28.99 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.709 179.751 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.974 ' CD2' HD22 ' A' ' 13' ' ' LEU . 0.0 OUTLIER 163.41 115.77 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.781 -179.725 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.492 ' N ' ' HB3' ' A' ' 4' ' ' PRO . 1.0 OUTLIER -87.86 37.91 0.82 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -178.508 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.553 ' H ' HD21 ' A' ' 13' ' ' LEU . 3.5 m 85.55 -28.27 0.08 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.911 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -72.23 -33.32 67.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.875 -179.692 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.416 ' HB2' ' HB2' ' A' ' 8' ' ' PHE . 0.2 OUTLIER -77.23 -4.47 44.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.332 179.911 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.974 HD22 ' CD2' ' A' ' 8' ' ' PHE . 0.1 OUTLIER -121.0 -15.13 8.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.611 179.705 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -112.23 -21.81 11.25 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.157 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.3 ttm180 -118.47 -55.78 2.19 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.681 0.277 . . . . 0.0 111.207 -179.769 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.0 -35.13 66.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.885 0.374 . . . . 0.0 110.728 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.9 OUTLIER -71.06 -57.73 4.25 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.342 179.534 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 20.5 mtm180 -60.48 -30.75 69.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.47 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -61.03 -41.23 96.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.838 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.552 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.5 p90 -98.13 -26.01 14.72 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.884 -0.327 . . . . 0.0 111.431 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -44.08 -58.52 2.79 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.915 0.388 . . . . 0.0 111.11 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.461 ' O ' HD13 ' A' ' 26' ' ' LEU . 20.6 mt-10 -73.63 -18.12 61.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.649 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.543 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 3.9 m-20 -106.94 33.46 3.94 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.986 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.95 -33.44 3.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.209 -178.019 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.483 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.2 p90 -100.24 -38.67 8.4 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.524 -178.084 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.57 HD23 HG23 ' A' ' 27' ' ' THR . 0.5 OUTLIER -54.1 -9.77 0.29 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.346 -179.77 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.57 HG23 HD23 ' A' ' 26' ' ' LEU . 1.0 OUTLIER -84.8 -16.71 40.54 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.871 179.77 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -138.8 15.07 2.69 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.315 179.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.13 -48.14 2.12 Favored 'General case' 0 CA--C 1.522 -0.103 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.379 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.402 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.5 OUTLIER -126.36 2.7 7.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.13 179.654 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.543 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.0 OUTLIER -60.41 -21.25 62.01 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 120.98 0.419 . . . . 0.0 110.741 179.391 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -88.34 -32.92 18.17 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 179.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.28 -36.31 79.18 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.851 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.819 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 12.7 mt -67.12 -60.64 2.45 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.837 179.58 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.2 t -50.48 -24.85 3.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.392 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 98.9 p -92.66 -33.78 14.23 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.676 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.41 24.39 9.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.707 0.289 . . . . 0.0 111.601 -179.526 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.714 HD21 ' CD2' ' A' ' 34' ' ' LEU . 1.8 mm? -128.1 -53.87 1.29 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.265 0.555 . . . . 0.0 110.507 179.599 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.71 -3.46 13.37 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.586 -178.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.476 HD13 ' HE1' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -94.92 -160.09 0.76 Allowed 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.399 0.618 . . . . 0.0 111.228 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.406 ' ND2' ' HG3' ' A' ' 42' ' ' GLU . 25.1 t30 -117.55 -80.79 0.61 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.902 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.406 ' HG3' ' ND2' ' A' ' 41' ' ' ASN . 0.1 OUTLIER -160.04 -43.49 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 179.662 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.945 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -67.53 -12.74 61.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.382 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.407 ' HB2' ' HB3' ' A' ' 40' ' ' LEU . 17.3 mp0 -102.19 -18.45 15.51 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.942 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 4.0 mm -62.21 -60.07 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.316 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.534 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -55.52 -19.69 10.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.22 178.332 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.945 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -77.85 -47.12 25.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -178.422 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.942 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 46.6 p-90 -67.67 -28.9 68.09 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 119.577 -0.849 . . . . 0.0 112.412 -177.361 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.719 ' HE2' HG22 ' A' ' 45' ' ' ILE . 17.5 m-85 -62.08 -43.79 98.07 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 177.348 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 47' ' ' ILE . 30.0 mt-30 -50.55 -34.08 24.2 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.04 179.238 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -83.81 -30.31 26.64 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.071 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.52 -27.92 63.53 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.709 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 -64.57 -28.83 69.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.924 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.91 -3.2 43.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.622 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 73.5 mttt 64.2 48.62 2.85 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.917 0.389 . . . . 0.0 110.807 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.8 tt -126.88 41.84 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.183 0.516 . . . . 0.0 110.943 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.7 mtp-105 -157.23 -45.8 0.07 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.794 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -44.53 95.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.852 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.4 t . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.928 179.951 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 N-CA-C 112.618 -0.193 . . . . 0.0 112.618 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -172.31 -176.99 1.71 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.816 0.341 . . . . 0.0 110.889 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -152.24 46.75 0.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.903 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.9 mttp -161.54 50.06 0.22 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.747 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.511 ' HB2' ' HB3' ' A' ' 7' ' ' ALA . 34.0 mtp180 63.32 126.05 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.013 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 91.3 Cg_endo -94.75 70.22 0.26 Allowed 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 123.122 2.548 . . . . 0.0 112.646 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.705 ' O ' ' HB ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -163.45 50.18 0.15 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.113 179.96 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.705 ' HB ' ' O ' ' A' ' 5' ' ' ARG . 2.1 m 80.25 -12.45 1.04 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.514 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.634 ' O ' ' CD1' ' A' ' 8' ' ' PHE . . . -68.3 -21.49 64.77 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.006 -0.277 . . . . 0.0 110.948 179.527 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.634 ' CD1' ' O ' ' A' ' 7' ' ' ALA . 2.1 m-30 148.48 110.99 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.43 0 O-C-N 124.059 0.85 . . . . 0.0 110.939 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.532 ' O ' ' CB ' ' A' ' 10' ' ' SER . 52.8 p -158.77 33.6 0.22 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.752 178.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.532 ' CB ' ' O ' ' A' ' 9' ' ' SER . 3.9 m 94.92 -30.67 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.502 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.02 -45.37 58.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.633 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.469 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 0.4 OUTLIER -70.8 -28.62 64.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.536 179.609 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.728 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -79.43 -21.33 45.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.379 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -100.85 -27.26 13.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.023 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -88.38 -47.57 8.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.096 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 12' ' ' GLN . . . -59.63 -42.8 93.53 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.715 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.497 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -63.71 -52.46 60.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.029 179.437 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 7.8 ttm180 -55.19 -28.87 56.11 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.974 179.398 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -82.58 -48.45 10.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.52 -178.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.523 ' HA ' ' OD1' ' A' ' 23' ' ' ASN . 0.7 OUTLIER -87.18 -29.33 21.84 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.419 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.457 ' HB3' ' O ' ' A' ' 17' ' ' LYS . 5.1 p-10 -52.66 -26.08 12.73 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.439 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -88.42 -12.48 43.05 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.81 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.841 ' HA ' HD22 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -128.4 38.23 4.01 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.11 0.481 . . . . 0.0 110.659 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.12 -45.78 4.82 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.518 0.675 . . . . 0.0 110.897 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.509 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.8 p90 -76.18 -42.68 45.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.861 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.841 HD22 ' HA ' ' A' ' 23' ' ' ASN . 1.3 pt? -52.98 -22.12 5.26 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.101 0.477 . . . . 0.0 110.707 -179.063 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.583 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 2.7 p -64.72 -21.35 66.73 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.551 178.584 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -130.8 11.55 5.19 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.859 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.401 ' HB3' ' CD ' ' A' ' 30' ' ' ARG . 0.3 OUTLIER -110.61 -47.57 3.24 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.729 -179.885 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.594 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -144.62 14.7 1.58 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.741 179.695 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.583 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.1 OUTLIER -75.04 -35.69 61.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.016 0.436 . . . . 0.0 109.924 179.352 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.1 mp0 -61.39 -25.64 67.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.952 179.02 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.536 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.2 OUTLIER -61.37 -37.33 83.0 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.072 179.446 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.788 HD13 ' HZ3' ' A' ' 48' ' ' TRP . 1.0 OUTLIER -73.52 -61.99 1.64 Allowed 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.226 178.705 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.475 ' HB2' HD12 ' A' ' 45' ' ' ILE . 19.7 t -45.65 -27.28 0.76 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.956 178.857 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.3 t -96.35 -17.47 20.63 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.765 -179.76 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 34' ' ' LEU . 22.8 mt-10 -121.52 20.52 11.12 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.753 0.311 . . . . 0.0 111.024 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.723 ' CB ' HD11 ' A' ' 40' ' ' LEU . 1.6 mm? -110.12 -55.56 2.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.25 0.548 . . . . 0.0 110.364 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 108.77 35.6 2.37 Favored Glycine 0 N--CA 1.448 -0.536 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.125 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.723 HD11 ' CB ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -122.2 -157.11 0.72 Allowed 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.192 0.52 . . . . 0.0 111.143 -179.165 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -126.11 -106.45 0.33 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.737 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -125.78 -40.1 2.08 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.883 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -77.66 1.89 18.43 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.486 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 16.8 mp0 -108.42 -21.07 12.9 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.831 HG22 ' HE2' ' A' ' 49' ' ' PHE . 32.7 mm -57.39 -59.05 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.907 0 CA-C-O 121.271 0.558 . . . . 0.0 109.711 178.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt -61.09 -16.33 42.79 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.451 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.883 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -73.8 -38.68 51.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -178.835 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.788 ' HZ3' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -69.51 -47.86 62.43 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 118.92 -1.112 . . . . 0.0 111.235 -179.501 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.831 ' HE2' HG22 ' A' ' 45' ' ' ILE . 2.1 m-85 -63.32 -41.41 98.91 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 121.037 -0.265 . . . . 0.0 111.042 -179.398 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.527 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 5.0 pt20 -64.04 -26.17 68.44 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.177 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 -90.73 -29.08 17.87 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.345 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.2 mtpp -80.63 -22.64 40.37 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.038 179.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.6 -32.61 11.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.981 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.21 -50.24 23.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.134 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.544 ' O ' HG22 ' A' ' 56' ' ' ILE . 1.6 mptt 61.7 38.2 15.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.877 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.544 HG22 ' O ' ' A' ' 55' ' ' LYS . 0.6 OUTLIER 46.77 36.18 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 CA-C-O 121.523 0.678 . . . . 0.0 110.815 -179.647 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -147.35 -48.98 0.18 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.926 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 44.32 36.56 1.63 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.413 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.2 m . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.288 -0.863 . . . . 0.0 110.849 179.983 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.214 0 N-CA-C 112.513 -0.235 . . . . 0.0 112.513 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -60.6 117.87 5.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.903 0.383 . . . . 0.0 110.948 -179.955 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' GLU . . . . . 0.553 ' HA ' ' HB1' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -157.79 52.81 0.46 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.912 179.999 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 44.8 pttt -172.5 48.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.831 179.984 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.442 ' H ' ' HB3' ' A' ' 7' ' ' ALA . 59.5 mtt85 -145.48 157.97 51.41 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.881 -179.997 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -68.94 71.3 1.12 Allowed 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.496 2.131 . . . . 0.0 112.294 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.592 ' O ' ' HB ' ' A' ' 6' ' ' THR . 5.3 ttt180 -169.21 56.86 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.722 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.592 ' HB ' ' O ' ' A' ' 5' ' ' ARG . 1.3 m 74.91 -5.44 2.15 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.62 -179.8 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.585 ' O ' ' HB2' ' A' ' 8' ' ' PHE . . . -89.58 25.47 1.99 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.985 0.421 . . . . 0.0 110.295 178.98 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.585 ' HB2' ' O ' ' A' ' 7' ' ' ALA . 69.3 m-85 77.06 111.98 0.07 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.399 179.984 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.528 ' O ' ' CB ' ' A' ' 10' ' ' SER . 29.9 t -165.27 37.77 0.06 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.675 179.256 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.528 ' CB ' ' O ' ' A' ' 9' ' ' SER . 5.8 t 93.97 -29.55 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.487 -179.706 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.04 -59.67 2.64 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.02 179.617 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -61.34 -15.83 39.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.522 177.988 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.622 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -79.2 -37.12 39.0 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.224 179.462 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.39 -29.05 52.99 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.628 179.47 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.06 -44.74 94.5 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.394 179.719 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.96 -26.13 65.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.483 179.284 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.676 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 4.4 mtmm -68.97 -53.5 20.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.207 179.352 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.5 ttp-105 -61.61 -29.28 69.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.051 179.034 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.89 -50.6 63.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.791 -179.894 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.676 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.2 p90 -82.02 -25.09 34.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.035 179.984 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -53.5 -25.46 16.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.999 0.428 . . . . 0.0 110.124 179.274 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.675 ' C ' HD21 ' A' ' 26' ' ' LEU . 1.7 mm-40 -100.75 17.99 20.56 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.98 179.484 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.596 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -159.32 34.17 0.2 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.024 0.44 . . . . 0.0 110.741 179.35 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.453 ' HD2' ' CE1' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -127.76 -36.34 2.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.198 -179.549 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.514 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 25.2 p90 -96.93 -46.41 6.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.748 -178.635 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.675 HD21 ' C ' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -48.58 -31.27 6.33 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.516 0.674 . . . . 0.0 109.641 179.84 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.55 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 1.4 p -53.65 -24.7 15.08 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.951 178.496 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -133.65 17.69 3.93 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.997 178.769 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.436 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -120.33 -50.0 2.25 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.697 -179.869 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.42 6.59 3.82 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.577 179.99 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.662 ' CG ' HG21 ' A' ' 45' ' ' ILE . 47.4 ttt180 -75.62 -7.34 54.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.701 0.286 . . . . 0.0 111.182 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -94.66 -23.33 17.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.356 0.598 . . . . 0.0 109.484 178.901 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -80.82 -42.77 21.09 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.888 179.037 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.996 ' CD2' HD21 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -63.51 -58.91 5.49 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.045 179.064 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.513 ' CB ' HD11 ' A' ' 45' ' ' ILE . 32.8 t -41.74 -32.32 0.38 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.272 179.331 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.5 m -89.71 -33.06 16.74 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.846 179.83 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.403 ' N ' ' O ' ' A' ' 34' ' ' LEU . 36.0 tt0 -67.32 -14.75 63.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.467 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.996 HD21 ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -112.04 -44.93 3.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.776 0.322 . . . . 0.0 110.722 -179.763 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 109.73 46.07 0.93 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.912 179.475 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.904 HD11 HD13 ' A' ' 38' ' ' LEU . 0.4 OUTLIER -144.85 -168.51 2.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.755 0.312 . . . . 0.0 111.011 179.689 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.697 ' O ' HG12 ' A' ' 45' ' ' ILE . 4.9 p30 -129.7 -175.15 3.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.86 -179.722 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.521 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 9.0 mt-10 -49.23 -34.69 15.56 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -177.939 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.835 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -63.19 -23.18 67.31 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -178.814 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.558 ' HB2' HD22 ' A' ' 40' ' ' LEU . 18.5 mp0 -112.03 -19.13 12.44 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 121.034 -0.266 . . . . 0.0 110.796 -179.272 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.907 HG22 ' HE2' ' A' ' 49' ' ' PHE . 38.8 mm -52.12 -60.73 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.845 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.454 ' HG3' HD12 ' A' ' 47' ' ' ILE . 34.6 pttt -59.21 -19.9 49.41 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.661 178.856 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.835 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.7 mp -78.63 -40.78 24.32 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -178.409 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.903 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -72.84 -31.94 65.11 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 118.513 -1.275 . . . . 0.0 112.296 -178.227 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.907 ' HE2' HG22 ' A' ' 45' ' ' ILE . 9.1 m-85 -66.4 -44.66 82.4 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 119.608 -0.837 . . . . 0.0 109.374 178.474 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.529 ' O ' ' HB2' ' A' ' 54' ' ' ALA . 1.5 pt20 -58.63 -27.23 64.51 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.207 179.751 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -88.89 -30.02 19.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.2 179.138 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.9 mmmt -76.41 -28.92 56.86 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.753 179.637 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.64 30.63 6.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.87 179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' A' ' 50' ' ' GLN . . . -71.48 -46.58 59.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.141 179.982 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.408 ' O ' ' HB ' ' A' ' 56' ' ' ILE . 0.4 OUTLIER -86.07 -40.81 15.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.882 179.925 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.408 ' HB ' ' O ' ' A' ' 55' ' ' LYS . 3.8 mt 79.95 69.02 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 121.229 0.537 . . . . 0.0 110.824 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -138.15 -46.81 0.52 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.872 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.3 -41.55 98.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.85 179.946 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.8 p . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.872 -179.965 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.201 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -97.0 136.69 37.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.842 0.353 . . . . 0.0 110.83 -179.914 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 63.4 47.16 4.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.788 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -149.29 48.75 0.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.896 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -105.96 164.73 14.38 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.983 -179.962 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.422 ' HB3' ' CB ' ' A' ' 9' ' ' SER . 60.1 Cg_endo -72.12 -166.6 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.593 2.195 . . . . 0.0 112.271 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.7 mtt-85 -117.4 31.68 6.59 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.185 0.516 . . . . 0.0 111.514 -179.959 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.59 ' O ' ' HB2' ' A' ' 7' ' ' ALA . 5.0 t -162.86 -45.53 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.771 179.403 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.59 ' HB2' ' O ' ' A' ' 6' ' ' THR . . . 160.91 -23.36 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.952 -179.689 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.603 ' CD2' HD11 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -161.66 104.59 1.22 Allowed 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.336 179.602 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.492 ' O ' ' CB ' ' A' ' 10' ' ' SER . 3.5 m -81.46 39.4 0.53 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -178.283 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.618 ' HA ' HD22 ' A' ' 13' ' ' LEU . 4.9 t 87.74 -29.51 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.905 179.512 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -64.25 -27.86 69.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.826 179.57 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.472 ' CB ' ' HB3' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -85.44 -44.22 12.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.038 179.333 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.618 HD22 ' HA ' ' A' ' 10' ' ' SER . 0.0 OUTLIER -59.36 -42.03 90.64 Favored 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.49 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.85 -18.72 61.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.875 179.492 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.8 -50.1 22.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.292 -179.768 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.48 -13.99 25.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.89 -179.723 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.514 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.4 OUTLIER -107.42 -38.85 5.82 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.896 0.379 . . . . 0.0 110.589 179.983 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -79.45 -32.59 42.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.375 -179.829 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -57.9 -39.41 77.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.862 -179.755 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.514 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.5 p90 -94.96 -38.02 10.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.417 -179.9 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.452 ' N ' ' CD1' ' A' ' 20' ' ' PHE . 3.3 m-20 -44.87 -40.12 5.97 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.893 0.378 . . . . 0.0 111.109 -179.698 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.779 ' O ' HD13 ' A' ' 26' ' ' LEU . 41.7 tt0 -82.03 -24.24 35.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.626 179.66 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.553 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 4.7 m-20 -110.62 33.69 4.39 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.562 -179.574 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.503 ' HB3' ' O ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -126.79 -35.45 2.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.32 -178.078 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.418 ' C ' ' H ' ' A' ' 27' ' ' THR . 4.7 p90 -101.89 -34.94 9.19 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.379 -178.211 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.779 HD13 ' O ' ' A' ' 22' ' ' GLU . 0.6 OUTLIER -55.11 -10.12 0.49 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.068 179.725 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.525 HG23 HD23 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -86.73 -16.87 35.11 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.931 179.92 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -140.08 17.74 2.45 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.193 179.218 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -127.41 -53.15 1.37 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.826 -179.559 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.414 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.8 OUTLIER -121.76 3.98 10.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.449 -179.947 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.59 -38.69 69.74 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.069 0.461 . . . . 0.0 110.304 179.669 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -71.88 -46.42 57.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.246 179.253 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.48 -32.85 65.39 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.266 0.555 . . . . 0.0 109.932 179.087 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.822 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 5.0 mt -67.51 -55.95 11.49 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.686 179.845 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.642 ' HA ' HD11 ' A' ' 45' ' ' ILE . 3.8 t -59.34 -21.12 59.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.035 -179.76 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.0 t -95.26 -14.16 24.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.569 -179.643 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -106.12 -29.05 10.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.01 0.433 . . . . 0.0 110.507 179.843 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.603 ' CB ' HD11 ' A' ' 40' ' ' LEU . 4.0 mm? -78.89 -58.55 3.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.749 179.778 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 109.81 15.98 11.34 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.813 -179.114 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.603 HD11 ' CB ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -107.98 -162.64 0.84 Allowed 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.144 0.497 . . . . 0.0 111.361 -179.851 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.44 ' CB ' ' HB2' ' A' ' 44' ' ' GLN . 0.7 OUTLIER -97.3 146.79 24.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.337 -179.783 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -52.19 -36.7 52.65 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 121.218 0.532 . . . . 0.0 109.904 179.573 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.561 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -75.77 -33.97 60.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.104 178.239 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.648 ' NE2' HG21 ' A' ' 47' ' ' ILE . 2.9 tm0? -75.82 -13.79 60.29 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.828 179.715 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.884 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 3.0 mm -65.53 -56.91 13.0 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.494 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.51 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.558 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 30.4 mtmt -54.45 -18.82 4.67 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.962 177.71 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.648 HG21 ' NE2' ' A' ' 44' ' ' GLN . 1.2 mp -76.1 -46.19 34.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -178.851 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.884 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 34.4 p-90 -68.19 -28.21 67.06 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 119.553 -0.859 . . . . 0.0 112.651 -177.453 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.788 ' HE2' HG22 ' A' ' 45' ' ' ILE . 12.1 m-85 -63.61 -42.54 98.21 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.542 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -56.78 -33.54 66.76 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.679 179.147 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -83.13 -29.81 28.38 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.126 179.204 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.26 -27.17 62.32 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.7 179.622 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.75 26.93 7.44 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.881 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.97 -35.5 80.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.088 179.985 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.405 ' O ' ' HB ' ' A' ' 56' ' ' ILE . 11.5 tttt -78.05 -47.26 18.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.405 ' HB ' ' O ' ' A' ' 55' ' ' LYS . 3.4 mt 79.53 68.77 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.259 0.552 . . . . 0.0 110.868 -179.718 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -164.61 -48.1 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.711 179.914 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.73 43.76 1.19 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.686 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.3 t . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.876 -179.947 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 112.541 -0.224 . . . . 0.0 112.541 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -159.63 77.59 0.69 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.78 0.324 . . . . 0.0 110.891 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -169.95 48.92 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.834 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.8 tmtm? 62.86 46.46 5.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.804 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.21 146.06 0.91 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.794 -179.967 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -81.31 -165.43 0.34 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.682 2.254 . . . . 0.0 112.403 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.421 ' O ' ' HB ' ' A' ' 6' ' ' THR . 26.3 mtt85 -109.48 33.22 4.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.218 0.533 . . . . 0.0 111.081 -179.966 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.717 HG23 ' H ' ' A' ' 7' ' ' ALA . 1.4 t 169.35 -63.94 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.864 179.378 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.717 ' H ' HG23 ' A' ' 6' ' ' THR . . . 175.27 45.87 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.057 -179.71 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.601 ' CD1' HD22 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -159.52 98.17 1.38 Allowed 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 114.725 -1.125 . . . . 0.0 111.518 -178.491 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.62 ' O ' HD23 ' A' ' 13' ' ' LEU . 0.2 OUTLIER -67.3 116.21 7.82 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.878 179.201 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.438 ' HA ' HD21 ' A' ' 13' ' ' LEU . 11.7 t -43.62 -31.4 0.75 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.2 0.524 . . . . 0.0 110.896 179.982 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -75.52 -1.42 24.2 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.069 179.411 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.539 ' N ' ' O ' ' A' ' 9' ' ' SER . 1.0 OUTLIER -112.76 -36.15 5.26 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.583 179.901 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.62 HD23 ' O ' ' A' ' 9' ' ' SER . 0.3 OUTLIER -87.15 -23.04 24.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.552 179.385 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.25 -30.42 70.44 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.545 179.393 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -99.92 -34.22 10.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.664 179.644 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.405 ' O ' ' N ' ' A' ' 20' ' ' PHE . . . -64.58 -33.07 75.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.265 179.435 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.589 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.1 OUTLIER -54.21 -26.98 31.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.33 179.288 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.432 ' HA ' ' ND2' ' A' ' 21' ' ' ASN . 1.0 OUTLIER -89.68 -28.64 19.31 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.754 179.668 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -94.06 -8.96 38.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.496 -179.126 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.589 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -117.38 -24.88 7.21 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -179.442 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.492 ' HB3' ' O ' ' A' ' 17' ' ' LYS . 5.8 p30 -50.26 -40.47 48.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.89 0.376 . . . . 0.0 110.739 179.879 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -81.31 -10.64 59.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.983 179.52 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.54 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER -102.66 32.32 3.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.273 0.559 . . . . 0.0 109.633 179.633 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.85 -42.12 2.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.146 -0.933 . . . . 0.0 111.453 -178.545 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.435 ' C ' ' H ' ' A' ' 27' ' ' THR . 6.9 p90 -88.92 -35.77 16.29 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.279 -178.692 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.54 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER -54.26 -9.02 0.24 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.15 0.5 . . . . 0.0 111.371 -179.891 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.484 HG23 HD23 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -88.01 -19.51 27.07 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.927 179.941 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -132.57 12.4 4.48 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.975 178.591 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.22 -44.44 1.14 Allowed 'General case' 0 C--O 1.231 0.098 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.111 179.981 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.427 ' HD3' ' CB ' ' A' ' 26' ' ' LEU . 14.9 mtp180 -110.97 -3.56 15.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.896 179.548 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -11.09 39.38 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.737 0.303 . . . . 0.0 111.066 179.773 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -95.91 -19.78 19.27 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.718 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.93 -47.89 8.61 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.994 179.234 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.965 HD22 ' CZ3' ' A' ' 48' ' ' TRP . 0.5 OUTLIER -61.66 -48.35 81.22 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.87 179.764 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.708 ' O ' HD12 ' A' ' 40' ' ' LEU . 6.1 t -50.49 -37.23 37.61 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.892 179.213 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.5 t -98.6 7.7 45.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.472 179.131 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.487 ' C ' HD12 ' A' ' 38' ' ' LEU . 11.5 tt0 -92.88 -38.48 11.7 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.583 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.758 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -107.82 19.57 19.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.353 -179.406 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 56.25 63.67 5.1 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.478 -0.867 . . . . 0.0 111.455 -179.185 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.734 HD13 ' HZ2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -137.93 -160.33 1.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.203 0.525 . . . . 0.0 111.952 -178.428 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.461 ' ND2' ' H ' ' A' ' 42' ' ' GLU . 2.5 p-10 -142.7 -83.89 0.17 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.001 179.97 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.461 ' H ' ' ND2' ' A' ' 41' ' ' ASN . 6.0 mp0 -141.45 -39.54 0.39 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.898 0.38 . . . . 0.0 110.633 -179.588 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.836 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -66.44 -12.96 59.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.691 -179.953 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.514 ' HB2' ' HB3' ' A' ' 40' ' ' LEU . 19.7 mp0 -111.88 -26.26 9.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.804 0.335 . . . . 0.0 110.53 -179.914 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.819 HG22 ' HE1' ' A' ' 49' ' ' PHE . 8.9 mm -60.52 -64.06 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.747 0 CA-C-O 121.352 0.596 . . . . 0.0 110.24 179.574 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -55.72 -21.85 20.76 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.322 179.576 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.836 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -64.35 -35.96 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.229 -179.642 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.965 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -71.69 -58.61 3.33 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.485 179.686 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.819 ' HE1' HG22 ' A' ' 45' ' ' ILE . 0.4 OUTLIER -60.26 -25.48 65.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.703 -179.563 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -57.08 -29.95 63.91 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.066 0.46 . . . . 0.0 110.03 179.22 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -88.24 -29.06 20.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.326 179.326 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.47 -26.23 41.74 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.879 179.737 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.2 tpt85 -103.78 27.41 7.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.895 179.904 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -121.33 28.66 7.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.138 179.842 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -109.96 -23.2 11.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.047 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -125.55 41.51 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 121.221 0.534 . . . . 0.0 110.875 179.947 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -172.13 -57.46 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.885 179.959 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.2 103.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.771 179.974 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.898 -179.978 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 112.44 -0.264 . . . . 0.0 112.44 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -72.7 109.91 6.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 0.0 110.891 179.971 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -171.04 63.38 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.875 179.993 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.8 tttm -173.89 64.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.904 -179.892 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.93 145.01 50.48 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.132 179.929 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.489 ' O ' HG22 ' A' ' 6' ' ' THR . 93.6 Cg_endo -81.6 140.63 11.92 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 123.111 2.541 . . . . 0.0 112.79 -179.5 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 61.85 46.69 6.63 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.946 179.662 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.659 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -170.59 -72.04 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.662 -179.982 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.659 ' H ' HG23 ' A' ' 6' ' ' THR . . . -70.22 -42.98 71.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.752 179.683 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.805 ' CG ' HD21 ' A' ' 13' ' ' LEU . 0.0 OUTLIER 169.22 113.98 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.558 179.716 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.46 ' O ' ' HB2' ' A' ' 10' ' ' SER . 2.4 p -88.19 38.25 0.85 Allowed 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -179.043 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.46 ' HB2' ' O ' ' A' ' 9' ' ' SER . 15.4 m 87.34 -29.92 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.695 179.624 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.33 -36.15 83.18 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.835 179.751 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.458 ' CB ' ' HB3' ' A' ' 8' ' ' PHE . 0.8 OUTLIER -78.94 -28.33 43.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.979 178.985 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.805 HD21 ' CG ' ' A' ' 8' ' ' PHE . 7.6 mt -74.97 -30.77 61.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.344 179.339 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.39 -30.61 30.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.416 -179.812 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.25 -46.55 12.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.182 -179.75 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.409 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . . . -60.01 -44.39 94.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.01 -179.932 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.564 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 1.1 ttmm -52.23 -37.36 54.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.493 179.812 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.5 ttm180 -87.98 -31.74 19.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.238 179.32 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.409 ' HB2' ' HA ' ' A' ' 16' ' ' ALA . 0.1 OUTLIER -64.32 -42.7 96.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.197 -179.811 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.718 ' HA ' ' OD1' ' A' ' 23' ' ' ASN . 3.5 p90 -89.52 -22.66 22.32 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.333 -179.739 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.557 ' HA ' ' CD ' ' A' ' 24' ' ' ARG . 0.3 OUTLIER -52.54 -32.84 42.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.048 0.451 . . . . 0.0 110.415 178.051 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -81.2 -9.06 59.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.382 -179.956 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.718 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -125.91 35.39 4.71 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.214 0.531 . . . . 0.0 111.082 179.814 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.646 ' O ' HG23 ' A' ' 27' ' ' THR . 24.0 mtm105 -100.26 -49.28 4.32 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.754 0.787 . . . . 0.0 110.412 179.853 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.518 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 4.7 p90 -47.75 -39.81 18.9 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.412 -1.267 . . . . 0.0 111.178 -179.876 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.518 ' N ' ' CG ' ' A' ' 25' ' ' TYR . 3.8 pp -51.19 -30.49 17.24 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.862 -179.074 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.646 HG23 ' O ' ' A' ' 24' ' ' ARG . 16.5 p -63.13 -19.27 64.3 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.3 -0.863 . . . . 0.0 109.832 179.163 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -131.94 8.05 4.41 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.481 178.748 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -113.27 -43.69 3.33 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.826 179.937 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.446 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -128.32 -1.36 5.67 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.616 179.853 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.827 ' NE ' HG21 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -72.9 -11.16 60.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.786 0.327 . . . . 0.0 110.981 179.702 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -102.66 -21.23 14.15 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.004 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -81.97 -41.14 21.2 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.112 179.294 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.65 HD13 ' CZ3' ' A' ' 48' ' ' TRP . 10.4 mt -67.79 -59.67 3.13 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.46 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.8 ' OG ' HD11 ' A' ' 45' ' ' ILE . 4.7 t -38.53 -32.94 0.09 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.675 178.756 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.8 t -81.06 -38.32 27.57 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.926 -179.334 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -86.95 -27.24 23.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.814 0.34 . . . . 0.0 111.473 -179.494 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.796 ' HB3' HD22 ' A' ' 40' ' ' LEU . 3.5 mm? -78.32 -2.93 40.45 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.643 -179.667 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 50.64 68.63 1.38 Allowed Glycine 0 C--N 1.334 0.469 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.608 179.884 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.796 HD22 ' HB3' ' A' ' 38' ' ' LEU . 1.9 pt? -153.21 -151.88 0.39 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.285 0.564 . . . . 0.0 111.694 -179.188 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -136.78 -84.12 0.35 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.804 -179.629 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.485 ' HA ' HG13 ' A' ' 45' ' ' ILE . 11.5 tt0 -141.01 -46.77 0.4 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.854 0.359 . . . . 0.0 111.487 -179.297 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.556 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -64.91 -17.43 64.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.716 -179.659 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.77 ' HA ' HD13 ' A' ' 47' ' ' ILE . 16.6 mp0 -98.56 -18.14 18.31 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.271 179.842 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.937 HD13 ' CZ2' ' A' ' 48' ' ' TRP . 6.8 mm -55.35 -46.61 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 178.154 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.36 -10.76 59.36 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.869 -1.059 . . . . 0.0 109.755 178.099 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.77 HD13 ' HA ' ' A' ' 44' ' ' GLN . 1.2 mp -73.08 -33.2 41.85 Favored 'Isoleucine or valine' 0 C--N 1.342 0.277 0 C-N-CA 121.016 -0.274 . . . . 0.0 111.234 -179.926 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.937 ' CZ2' HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -70.87 -60.5 2.2 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.322 179.606 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.854 ' HE2' HG22 ' A' ' 45' ' ' ILE . 1.0 OUTLIER -58.84 -30.07 67.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.509 -179.735 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.484 ' O ' ' HB2' ' A' ' 54' ' ' ALA . 4.8 mt-30 -51.0 -26.85 6.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.103 0.478 . . . . 0.0 109.938 178.961 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -84.7 -31.75 23.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.201 179.106 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.5 ttmm -69.42 -29.44 67.17 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.627 179.593 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -109.07 30.47 6.54 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.794 179.946 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.484 ' HB2' ' O ' ' A' ' 50' ' ' GLN . . . -122.12 30.98 6.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.093 -179.985 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.08 31.69 4.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.89 179.944 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.7 tt -177.02 42.64 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.248 0.547 . . . . 0.0 110.994 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.9 ttt180 -135.81 -38.86 0.71 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.876 -179.955 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.66 60.33 1.66 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.912 179.992 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.887 -179.915 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.163 0 N-CA-C 112.451 -0.26 . . . . 0.0 112.451 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -110.0 97.4 6.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.809 0.338 . . . . 0.0 110.885 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -163.39 47.73 0.13 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.761 -179.999 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.6 tttt -157.45 47.93 0.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.073 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.3 130.67 5.63 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.94 179.949 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.422 ' HB2' HG22 ' A' ' 6' ' ' THR . 96.3 Cg_endo -86.76 -165.37 0.25 Allowed 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.825 2.35 . . . . 0.0 112.437 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.66 44.08 3.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.154 0.502 . . . . 0.0 110.405 179.739 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.594 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -120.88 -78.52 0.59 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.549 -179.945 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.594 ' H ' HG23 ' A' ' 6' ' ' THR . . . -100.65 24.8 8.55 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.0 0.429 . . . . 0.0 110.391 179.265 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.526 ' CE1' ' HB3' ' A' ' 13' ' ' LEU . 3.8 m-85 -141.16 86.91 2.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.803 -179.63 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.483 ' O ' ' CB ' ' A' ' 10' ' ' SER . 18.9 t -111.94 32.42 5.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.045 0.45 . . . . 0.0 111.458 -179.835 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.562 ' H ' HD21 ' A' ' 13' ' ' LEU . 3.5 m 88.38 -27.22 0.06 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.342 179.479 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.54 1.8 57.05 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.966 -178.976 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.69 -18.49 10.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.71 0.29 . . . . 0.0 111.187 179.683 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.565 HD23 ' H ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -104.71 -27.62 11.69 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.922 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.437 ' HB2' ' O ' ' A' ' 10' ' ' SER . . . -58.25 -29.22 65.6 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.295 178.975 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -83.95 -43.73 14.92 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.405 179.444 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.24 -29.31 69.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.332 179.285 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.685 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 11.2 ttmt -66.91 -56.5 9.99 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.924 179.367 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.8 ttm-85 -57.44 -29.2 63.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.571 179.196 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -69.68 -49.94 48.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.452 -179.559 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.685 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.6 p90 -85.45 -22.2 28.39 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -179.3 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -52.49 -22.9 5.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.776 0.322 . . . . 0.0 110.429 179.141 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -105.52 12.9 30.83 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.543 -179.889 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.523 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.7 OUTLIER -151.48 35.23 0.56 Allowed 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 179.621 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.624 ' O ' HG23 ' A' ' 27' ' ' THR . 8.0 mmt180 -148.2 -46.22 0.16 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.774 0.797 . . . . 0.0 109.976 179.556 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.51 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 6.1 p90 -58.02 -39.05 77.39 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.546 -1.206 . . . . 0.0 110.248 179.811 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.573 ' HA ' ' HB3' ' A' ' 29' ' ' ARG . 2.1 pt? -52.67 -30.12 30.22 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.342 -179.564 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.624 HG23 ' O ' ' A' ' 24' ' ' ARG . 3.7 p -64.28 -18.33 64.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.661 178.918 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -137.04 19.91 3.0 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.078 178.829 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.573 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.7 OUTLIER -126.1 -41.57 1.92 Allowed 'General case' 0 C--O 1.231 0.11 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.089 -179.454 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.484 ' HD3' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -149.7 19.98 0.91 Allowed 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.766 0.284 . . . . 0.0 111.766 -179.781 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.532 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.6 OUTLIER -81.47 -26.11 35.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.858 0.361 . . . . 0.0 110.474 179.687 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -86.46 -21.65 26.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.173 179.145 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.5 -45.14 12.93 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.082 179.344 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.901 HD22 ' CH2' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -62.88 -57.65 10.08 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.814 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.584 ' CB ' HD11 ' A' ' 45' ' ' ILE . 29.9 t -40.53 -32.98 0.23 Allowed 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.186 179.718 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.36 -30.08 47.79 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.856 179.727 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.564 ' N ' ' O ' ' A' ' 34' ' ' LEU . 31.5 mt-10 -71.28 -57.13 4.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.811 179.812 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 1.054 HD23 HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.39 -47.43 85.47 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.125 0.488 . . . . 0.0 110.34 179.7 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.31 30.9 5.48 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.333 -178.837 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 1.054 HD11 HD23 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -126.61 -168.29 1.84 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.019 0.437 . . . . 0.0 111.343 -179.48 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.6 ' O ' HG12 ' A' ' 45' ' ' ILE . 2.5 p-10 -124.09 176.83 6.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.064 179.878 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.44 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 13.6 mp0 -46.85 -30.93 2.74 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.006 -178.675 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.712 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -63.63 -19.85 65.2 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.115 -179.481 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.663 ' CB ' HD22 ' A' ' 40' ' ' LEU . 14.7 mp0 -118.72 -20.9 8.09 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.557 -179.023 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.875 HG22 ' HE2' ' A' ' 49' ' ' PHE . 46.9 mm -50.81 -58.08 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.473 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.431 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 1.5 mtmt -60.34 -25.08 65.55 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.481 178.391 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.712 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.6 mp -70.93 -39.31 75.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -178.585 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.901 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -74.45 -40.6 61.81 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 118.401 -1.32 . . . . 0.0 111.907 -178.859 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.875 ' HE2' HG22 ' A' ' 45' ' ' ILE . 2.8 m-85 -59.92 -33.74 72.27 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.347 -0.941 . . . . 0.0 108.663 178.025 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.4 ' NE2' ' O ' ' A' ' 46' ' ' LYS . 0.9 OUTLIER -49.32 -27.81 4.26 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.909 179.163 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -88.71 -31.12 18.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.218 179.319 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.8 mmtm -77.82 -27.31 49.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.86 179.707 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.52 -41.63 60.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.783 179.887 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.699 ' HB1' ' HB3' ' A' ' 58' ' ' ARG . . . -74.13 -22.62 59.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.197 179.961 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.558 ' O ' HG22 ' A' ' 56' ' ' ILE . 11.5 mmtt 61.95 32.76 17.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.844 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.558 HG22 ' O ' ' A' ' 55' ' ' LYS . 0.6 OUTLIER 47.07 36.13 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.204 0 CA-C-O 121.491 0.662 . . . . 0.0 110.869 -179.623 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.444 ' O ' ' HG2' ' A' ' 58' ' ' ARG . 25.5 mtt180 -149.65 -46.77 0.13 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.86 -179.996 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.699 ' HB3' ' HB1' ' A' ' 54' ' ' ALA . 0.3 OUTLIER 33.8 53.92 0.51 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.908 179.916 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.91 179.913 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.58 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--O 1.23 0.056 0 CA-C-O 121.16 0.505 . . . . 0.0 110.167 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.2 tpp180 -126.17 -35.59 2.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.228 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.493 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 20.5 p90 -100.58 -46.18 5.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.702 -178.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.585 HD23 ' H ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -48.69 -29.84 4.87 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.43 0.633 . . . . 0.0 110.0 -179.939 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.455 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.8 OUTLIER -55.2 -24.71 28.58 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.886 178.617 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.82 8.73 5.32 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.462 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.461 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.9 OUTLIER -112.58 -50.83 2.87 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.828 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.438 ' HD3' ' CB ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -119.93 -7.33 9.96 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.69 -179.797 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.525 ' NE ' HG21 ' A' ' 45' ' ' ILE . 10.2 ttt180 -53.44 -33.59 54.65 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.109 0.48 . . . . 0.0 110.389 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -74.03 -29.69 62.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.508 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.491 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -72.59 -38.95 67.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.461 179.807 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.72 ' HB3' ' CZ3' ' A' ' 48' ' ' TRP . 6.7 mt -70.86 -62.12 1.51 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.9 t -46.48 -29.45 1.76 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.913 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.9 m -73.81 -47.98 34.75 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.163 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.85 -10.7 56.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.024 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.691 ' HG ' ' CZ2' ' A' ' 48' ' ' TRP . 2.2 mm? -89.32 -27.73 20.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.661 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.64 65.51 3.38 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.925 -179.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.872 HD22 ' CB ' ' A' ' 44' ' ' GLN . 1.3 pp -157.34 -162.89 1.27 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.978 0.418 . . . . 0.0 111.312 -179.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.533 ' O ' HG12 ' A' ' 45' ' ' ILE . 19.4 m-20 -123.07 -177.68 3.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.611 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -58.36 -24.43 59.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.962 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.886 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -72.47 -4.9 33.14 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.872 ' CB ' HD22 ' A' ' 40' ' ' LEU . 0.9 OUTLIER -120.84 -25.7 5.37 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.951 0.405 . . . . 0.0 109.959 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 1.02 HG22 ' CE2' ' A' ' 49' ' ' PHE . 14.7 mm -57.36 -59.35 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.913 0 CA-C-O 121.661 0.743 . . . . 0.0 109.148 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.498 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 0.2 OUTLIER -55.75 -29.42 59.52 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.528 -1.215 . . . . 0.0 110.144 179.612 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.886 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -59.39 -32.79 49.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.682 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.72 ' CZ3' ' HB3' ' A' ' 34' ' ' LEU . 1.5 m0 -69.97 -63.9 0.99 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.522 0.677 . . . . 0.0 110.112 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 1.02 ' CE2' HG22 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -62.31 -28.22 69.58 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.561 -179.441 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.498 ' CB ' ' O ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -62.96 -32.96 74.4 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 178.86 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.022 178.979 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.77 ' HB2' HD11 ' A' ' 26' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 121.503 0.668 . . . . 0.0 110.616 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.37 -35.51 7.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.572 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.521 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.7 p90 -92.19 -44.34 8.83 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.926 -1.033 . . . . 0.0 111.767 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.77 HD11 ' HB2' ' A' ' 23' ' ' ASN . 0.3 OUTLIER -46.32 -27.33 1.01 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.315 0.579 . . . . 0.0 110.969 -179.13 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.431 HG23 ' H ' ' A' ' 27' ' ' THR . 1.1 p -58.57 -19.73 40.68 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.105 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -123.85 -17.72 6.23 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.438 178.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.441 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 4.6 tmt_? -96.21 -53.08 3.75 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-O 120.948 0.404 . . . . 0.0 110.503 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.525 ' HB2' ' HB2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -82.41 -27.82 31.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.392 179.438 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.555 ' HG3' HG21 ' A' ' 45' ' ' ILE . 27.4 ttt180 -49.77 -29.91 8.59 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 178.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -77.62 -32.48 53.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.383 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.511 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.2 OUTLIER -77.84 -40.43 40.32 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.537 179.621 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.71 HD13 ' CZ3' ' A' ' 48' ' ' TRP . 1.5 mt -63.14 -54.05 43.78 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.082 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.1 t -41.72 -30.8 0.25 Allowed 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.734 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.3 m -120.52 14.97 11.99 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.459 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -105.85 -45.25 4.42 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.782 0.289 . . . . 0.0 111.782 -179.871 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 1.05 HD11 HD21 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -103.34 14.62 31.1 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -179.114 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.11 69.4 1.29 Allowed Glycine 0 CA--C 1.509 -0.343 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.577 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 1.05 HD21 HD11 ' A' ' 38' ' ' LEU . 0.9 OUTLIER -101.25 -164.91 1.15 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.859 0.362 . . . . 0.0 111.873 -179.251 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -126.55 16.55 7.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.038 -178.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.432 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 0.7 OUTLIER 66.9 7.81 5.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.67 0.271 . . . . 0.0 111.28 -179.841 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.783 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -117.62 -29.64 5.7 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.953 0.406 . . . . 0.0 110.533 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.516 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -88.43 -4.32 58.66 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.879 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.787 HG22 ' HE1' ' A' ' 49' ' ' PHE . 9.1 mm -60.41 -58.78 5.8 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.05 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.904 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.483 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 13.8 pttt -62.17 -19.32 62.96 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.909 -1.041 . . . . 0.0 109.631 178.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.783 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.7 mp -67.34 -34.89 71.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.785 ' CH2' HG23 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -69.82 -60.21 2.45 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 119.903 -0.719 . . . . 0.0 110.238 179.832 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.787 ' HE1' HG22 ' A' ' 45' ' ' ILE . 1.4 m-85 -57.73 -29.78 65.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.385 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.483 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -51.79 -29.83 20.64 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.084 0.469 . . . . 0.0 110.074 178.94 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.612 179.652 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.517 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.522 -0.12 0 CA-C-O 121.295 0.569 . . . . 0.0 109.715 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -121.83 -38.75 2.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.821 -178.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.45 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 13.0 p90 -89.95 -39.01 13.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.545 -178.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.517 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 1.0 OUTLIER -53.05 -14.63 0.64 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 121.107 0.48 . . . . 0.0 111.089 -179.742 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.44 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -77.5 -20.43 54.31 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.811 179.52 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -133.98 14.18 3.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.116 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.435 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -118.53 -42.73 2.74 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.821 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.72 9.61 3.36 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.411 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.612 ' HD3' HG21 ' A' ' 45' ' ' ILE . 1.7 ttm180 -71.59 -46.28 59.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.899 0.38 . . . . 0.0 110.624 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -61.95 -27.89 69.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.887 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.474 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -74.73 -39.46 61.86 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.594 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.686 HD13 ' CZ3' ' A' ' 48' ' ' TRP . 9.8 mt -69.13 -58.49 4.0 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.847 ' OG ' HD11 ' A' ' 45' ' ' ILE . 1.7 t -40.11 -33.22 0.21 Allowed 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.271 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.4 m -77.24 -39.02 49.92 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.303 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -91.18 -9.21 46.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.629 -179.765 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.718 ' HB3' HD22 ' A' ' 40' ' ' LEU . 4.3 mm? -99.03 2.93 46.68 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.607 0.242 . . . . 0.0 111.451 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 46.84 70.14 0.74 Allowed Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.992 -0.623 . . . . 0.0 113.072 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.765 HD11 HD13 ' A' ' 45' ' ' ILE . 1.8 pt? -156.66 -151.45 0.32 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.295 0.569 . . . . 0.0 111.659 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -136.55 -89.49 0.29 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.098 -0.956 . . . . 0.0 111.615 -179.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.46 ' HA ' HG13 ' A' ' 45' ' ' ILE . 14.0 mm-40 -136.97 -46.46 0.58 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.776 0.322 . . . . 0.0 111.605 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.578 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -66.11 -19.15 65.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.751 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.806 ' HA ' HD13 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -95.61 -17.07 21.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.973 0.416 . . . . 0.0 110.082 179.838 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.916 HD13 ' CZ2' ' A' ' 48' ' ' TRP . 8.3 mm -54.66 -49.48 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 178.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -66.38 -11.11 49.61 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.913 177.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.806 HD13 ' HA ' ' A' ' 44' ' ' GLN . 1.3 mp -73.67 -33.29 38.05 Favored 'Isoleucine or valine' 0 C--N 1.343 0.29 0 C-N-CA 121.034 -0.266 . . . . 0.0 111.553 -179.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.916 ' CZ2' HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -69.11 -60.1 2.58 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.312 179.661 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.793 ' HE2' HG22 ' A' ' 45' ' ' ILE . 1.3 m-85 -57.16 -33.27 67.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.695 -179.282 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.89 -30.15 61.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.08 0.467 . . . . 0.0 109.854 179.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.997 179.205 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.444 ' O ' ' CG ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER . . . . . 0 CA--C 1.538 0.515 0 CA-C-O 120.89 0.376 . . . . 0.0 111.294 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.897 ' O ' HG23 ' A' ' 27' ' ' THR . 12.1 mtt180 -133.28 -55.95 0.91 Allowed 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.161 0.505 . . . . 0.0 110.69 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.485 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 1.3 p90 -37.78 -34.37 0.11 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.277 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.685 HD23 ' C ' ' A' ' 24' ' ' ARG . 2.2 pt? -51.58 -28.67 14.69 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.206 -178.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.897 HG23 ' O ' ' A' ' 24' ' ' ARG . 2.5 p -70.83 -14.96 62.6 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.972 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -136.92 15.68 3.07 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.09 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' A' ' 25' ' ' TYR . 16.4 tpt85 -121.62 -48.07 2.18 Favored 'General case' 0 C--O 1.23 0.055 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.579 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.401 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -119.91 -14.28 8.96 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.553 179.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.756 ' CG ' HG21 ' A' ' 45' ' ' ILE . 1.7 ttm180 -56.92 -22.49 37.96 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.672 0.273 . . . . 0.0 110.968 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -84.11 -25.17 29.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.048 0.451 . . . . 0.0 109.98 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.91 -44.09 15.77 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.044 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.858 ' O ' HD22 ' A' ' 38' ' ' LEU . 0.2 OUTLIER -64.35 -59.52 4.27 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 178.788 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.6 ' CB ' HD11 ' A' ' 45' ' ' ILE . 30.1 t -39.13 -33.04 0.11 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.374 179.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 12.9 m -78.88 -28.35 44.1 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.163 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 34' ' ' LEU . 3.0 tt0 -73.42 -60.63 2.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.877 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 1.091 HD23 HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -56.57 -49.77 73.88 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 121.05 0.453 . . . . 0.0 110.329 179.756 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 108.95 46.26 0.96 Allowed Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.721 -179.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 1.091 HD11 HD23 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -130.17 -160.38 1.03 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.113 0.482 . . . . 0.0 111.413 -179.322 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -118.69 -88.76 0.61 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.675 -0.693 . . . . 0.0 112.068 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.401 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 0.2 OUTLIER -141.04 -46.14 0.39 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.76 0.314 . . . . 0.0 111.1 -179.325 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.949 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -65.98 -12.89 58.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.165 179.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.534 ' NE2' ' H ' ' A' ' 44' ' ' GLN . 0.3 OUTLIER -101.14 -20.27 15.39 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.485 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.885 HG22 ' HE2' ' A' ' 49' ' ' PHE . 41.9 mm -57.58 -60.58 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.501 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -58.02 -16.79 13.9 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.704 178.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.949 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -77.37 -36.08 23.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -178.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.858 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.8 -31.69 46.07 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 118.653 -1.219 . . . . 0.0 111.777 -179.354 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.885 ' HE2' HG22 ' A' ' 45' ' ' ILE . 4.9 m-85 -65.54 -42.49 91.88 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.064 178.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.465 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 6.5 pt20 -61.18 -28.4 69.11 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.741 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 . . . . . 0 N--CA 1.452 -0.326 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.949 178.761 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.83 ' HA ' HD22 ' A' ' 26' ' ' LEU . 0.7 OUTLIER . . . . . 0 CA--C 1.529 0.137 0 CA-C-O 120.851 0.358 . . . . 0.0 111.385 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.432 ' O ' HG23 ' A' ' 27' ' ' THR . 0.0 OUTLIER -124.91 -38.5 2.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.308 0.575 . . . . 0.0 111.0 -179.548 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.476 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 15.9 p90 -83.54 -40.7 18.81 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.0 -179.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.83 HD22 ' HA ' ' A' ' 23' ' ' ASN . 2.2 pt? -47.76 -28.22 2.4 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.357 0.598 . . . . 0.0 110.536 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.439 ' H ' HD23 ' A' ' 26' ' ' LEU . 1.2 p -58.2 -23.91 57.29 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.783 178.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -130.31 21.39 5.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.703 178.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.54 -51.24 1.38 Allowed 'General case' 0 C--O 1.231 0.087 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.94 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.515 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -131.26 4.29 4.36 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.855 -179.681 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 26' ' ' LEU . 2.9 ttt180 -58.61 -26.42 63.66 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.871 0.367 . . . . 0.0 110.667 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.94 -21.11 34.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.055 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.95 -37.95 15.97 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.635 -0.712 . . . . 0.0 109.52 179.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.837 HD22 HD21 ' A' ' 38' ' ' LEU . 0.5 OUTLIER -65.37 -49.27 69.95 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.672 178.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.79 ' HA ' HD11 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -47.91 -27.09 1.97 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.092 179.266 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.99 -11.9 27.66 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.601 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.403 ' N ' ' O ' ' A' ' 34' ' ' LEU . 9.6 tp10 -76.91 -62.51 1.62 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.638 0.256 . . . . 0.0 110.955 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.934 HD23 ' CD1' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -69.15 -47.63 64.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.187 0.518 . . . . 0.0 110.177 179.528 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 124.68 2.54 8.03 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.501 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.934 ' CD1' HD23 ' A' ' 38' ' ' LEU . 0.2 OUTLIER -102.15 -165.42 1.18 Allowed 'General case' 0 CA--C 1.527 0.093 0 CA-C-O 121.095 0.474 . . . . 0.0 111.396 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.545 ' O ' HG12 ' A' ' 45' ' ' ILE . 17.4 t30 -113.76 166.91 11.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.314 -179.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.56 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 91.4 mt-10 -53.07 -28.31 24.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.479 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.792 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -63.82 -48.92 74.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.982 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.545 ' H ' HE21 ' A' ' 44' ' ' GLN . 0.0 OUTLIER -87.11 -15.09 39.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.225 179.414 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.964 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 2.5 mm -59.94 -58.62 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.538 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 0.2 OUTLIER -57.32 -18.15 15.66 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.1 178.012 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.792 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -79.39 -48.39 21.14 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 -178.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.964 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 34.0 p-90 -63.91 -25.84 68.33 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 119.392 -0.923 . . . . 0.0 112.177 -177.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.661 ' HE2' HG22 ' A' ' 45' ' ' ILE . 27.5 m-85 -66.33 -53.1 40.17 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 177.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.423 ' CG ' ' O ' ' A' ' 47' ' ' ILE . 1.7 pt20 -53.03 -26.49 15.86 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.252 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.024 178.963 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.519 ' HA ' ' CG ' ' A' ' 26' ' ' LEU . 1.7 m-80 . . . . . 0 CA--C 1.519 -0.227 0 CA-C-O 121.514 0.673 . . . . 0.0 109.784 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.6 -20.68 15.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.275 -179.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.514 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 12.4 p90 -116.26 -44.6 2.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.487 -178.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.521 ' HB2' ' HB3' ' A' ' 30' ' ' ARG . 0.5 OUTLIER -48.98 -27.11 2.91 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.304 0.574 . . . . 0.0 110.382 -179.811 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.419 HG23 ' H ' ' A' ' 27' ' ' THR . 0.5 OUTLIER -59.53 -24.0 63.32 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.839 178.907 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -130.93 0.29 4.25 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.996 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.85 -29.54 6.35 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.988 0.423 . . . . 0.0 110.997 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.521 ' HB3' ' HB2' ' A' ' 26' ' ' LEU . 6.6 ttm180 -115.89 -24.39 8.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.895 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.627 ' HG3' HG21 ' A' ' 45' ' ' ILE . 32.4 ttp180 -49.47 -31.57 10.25 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.188 0.518 . . . . 0.0 110.161 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -38.29 73.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.973 179.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.444 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.6 OUTLIER -78.02 -37.11 47.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.94 179.219 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.852 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 4.0 mt -67.41 -41.73 84.4 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.519 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.778 ' HA ' HD11 ' A' ' 45' ' ' ILE . 3.4 t -55.66 -26.92 47.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.649 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -112.05 3.13 17.17 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.101 179.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.574 ' HB3' HD23 ' A' ' 38' ' ' LEU . 4.4 tt0 -85.57 -48.03 9.31 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.024 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.968 HD12 HD21 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -96.34 -31.92 12.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.797 0.332 . . . . 0.0 110.479 179.645 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 104.31 46.28 1.35 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.546 -0.835 . . . . 0.0 113.315 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.968 HD21 HD12 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -127.25 -163.95 1.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.979 0.419 . . . . 0.0 111.331 179.227 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.432 ' O ' HG12 ' A' ' 45' ' ' ILE . 1.0 OUTLIER -97.96 148.64 23.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.017 -179.176 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -53.77 -40.45 66.27 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.099 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.661 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -71.96 -31.12 65.99 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 121.755 0.788 . . . . 0.0 109.247 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.517 ' HA ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -77.73 -14.82 59.49 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.177 -1.374 . . . . 0.0 110.273 -179.832 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.825 HD13 ' HE1' ' A' ' 48' ' ' TRP . 5.9 mm -63.29 -57.19 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.464 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -58.39 -16.53 15.14 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.917 177.795 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.661 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -79.39 -39.64 20.98 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.143 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -178.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.852 ' CZ2' HD22 ' A' ' 34' ' ' LEU . 27.1 p-90 -74.06 -27.54 60.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 118.732 -1.187 . . . . 0.0 112.319 -178.06 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.79 ' HE2' HG22 ' A' ' 45' ' ' ILE . 7.4 m-85 -68.48 -46.29 70.1 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.9 pt20 -60.54 -25.6 66.26 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.829 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 . . . . . 0 N--CA 1.453 -0.322 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.985 178.742 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.66 ' HA ' HD11 ' A' ' 26' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.219 0 CA-C-O 120.778 0.323 . . . . 0.0 110.27 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.75 -44.1 1.68 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.117 0.484 . . . . 0.0 110.905 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.984 ' CE1' HD23 ' A' ' 26' ' ' LEU . 15.4 p90 -93.35 -45.94 7.58 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.096 -179.112 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.984 HD23 ' CE1' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -51.16 -27.28 8.29 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.325 0.583 . . . . 0.0 110.124 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.4 p -59.52 -21.87 60.82 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.94 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -131.37 1.32 4.14 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.712 178.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -115.91 -31.59 5.71 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 120.948 0.404 . . . . 0.0 111.009 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.441 ' HB3' ' HB2' ' A' ' 26' ' ' LEU . 4.8 ttt85 -117.57 -23.62 7.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.275 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.592 ' CG ' HG21 ' A' ' 45' ' ' ILE . 34.7 ttp180 -50.74 -30.06 12.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.045 0.45 . . . . 0.0 110.615 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.46 -31.1 62.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.338 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.471 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.3 OUTLIER -75.86 -37.53 58.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.408 179.615 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.681 ' HB3' ' CH2' ' A' ' 48' ' ' TRP . 6.9 mt -68.29 -62.7 1.28 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 39.5 t -43.06 -30.17 0.41 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.196 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.6 t -79.18 -38.72 35.18 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.265 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.64 -15.81 31.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.074 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.709 ' HG ' ' CZ2' ' A' ' 48' ' ' TRP . 2.7 mm? -88.98 -27.58 20.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.631 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 58.91 65.52 3.43 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.719 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.811 HD22 ' CB ' ' A' ' 44' ' ' GLN . 0.5 OUTLIER -154.66 -164.78 1.9 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.993 0.425 . . . . 0.0 111.577 -178.889 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.449 ' O ' ' NE2' ' A' ' 44' ' ' GLN . 35.5 t30 -118.97 172.07 7.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.321 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.416 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 5.5 mt-10 -53.39 -23.53 9.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.678 0.275 . . . . 0.0 111.469 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.905 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -70.1 -9.45 55.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.933 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.811 ' CB ' HD22 ' A' ' 40' ' ' LEU . 1.1 mp0 -117.32 -26.65 6.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.053 0.454 . . . . 0.0 109.78 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.997 HG22 ' HE2' ' A' ' 49' ' ' PHE . 12.9 mm -57.41 -59.26 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.426 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -55.9 -25.54 43.33 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.129 179.281 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.905 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -62.89 -32.51 56.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.748 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.724 ' CZ2' HD13 ' A' ' 45' ' ' ILE . 1.1 m0 -70.89 -63.93 1.0 Allowed 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.523 0.678 . . . . 0.0 110.229 179.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.997 ' HE2' HG22 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -61.97 -24.22 66.88 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.82 -179.244 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.3 mt-30 -56.88 -29.15 62.68 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.211 179.344 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.798 ' HB2' HD11 ' A' ' 26' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.186 0 CA-C-O 121.568 0.699 . . . . 0.0 110.677 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.482 ' O ' HG23 ' A' ' 27' ' ' THR . 0.1 OUTLIER -93.66 -48.69 6.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.175 179.722 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.511 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 10.8 p90 -70.69 -43.84 68.21 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.682 -1.144 . . . . 0.0 111.696 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.798 HD11 ' HB2' ' A' ' 23' ' ' ASN . 1.2 pp -53.87 -20.64 6.23 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.201 0.524 . . . . 0.0 110.754 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.494 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 3.3 p -65.82 -19.06 65.75 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.037 178.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -135.08 16.29 3.5 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.726 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.409 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -118.5 -51.41 2.4 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.639 -179.761 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.531 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -132.81 7.88 4.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.467 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.494 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 47.3 ttt180 -80.06 -2.37 44.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.903 0.382 . . . . 0.0 110.867 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -97.59 -28.91 13.73 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -69.78 -35.33 74.8 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.56 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.051 HD23 HD21 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -66.31 -63.87 0.98 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.446 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.511 ' CB ' HD11 ' A' ' 45' ' ' ILE . 17.8 t -40.3 -31.79 0.15 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.943 -1.026 . . . . 0.0 111.539 179.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.47 -36.98 21.91 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.946 -179.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -85.09 -19.37 31.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.894 0.378 . . . . 0.0 111.07 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 1.051 HD21 HD23 ' A' ' 34' ' ' LEU . 4.4 mm? -78.3 -49.98 12.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.779 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 104.48 21.22 9.45 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.718 -0.673 . . . . 0.0 111.818 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.77 HD13 HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -109.02 -160.54 0.72 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.163 0.506 . . . . 0.0 111.101 -179.847 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -120.84 -101.04 0.42 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.486 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -129.63 -42.62 1.29 Allowed 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.722 0.296 . . . . 0.0 111.516 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.918 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -73.36 -2.78 23.58 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.763 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.506 ' NE2' ' N ' ' A' ' 44' ' ' GLN . 0.9 OUTLIER -106.02 -23.29 12.68 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.407 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.858 HG22 ' HE2' ' A' ' 49' ' ' PHE . 38.5 mm -56.8 -61.21 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.869 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -15.37 11.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.796 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.918 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.4 mp -79.11 -36.19 18.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -178.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.927 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.68 -29.65 45.74 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 118.463 -1.295 . . . . 0.0 111.902 -179.155 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.858 ' HE2' HG22 ' A' ' 45' ' ' ILE . 4.5 m-85 -69.41 -42.19 75.4 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 119.683 -0.807 . . . . 0.0 109.187 178.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.467 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 5.8 pt20 -60.81 -28.77 69.03 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.968 179.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.056 178.916 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.529 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.136 0 CA-C-O 121.311 0.577 . . . . 0.0 109.855 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.66 -40.74 2.31 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.625 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.428 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 7.9 p90 -89.91 -36.71 14.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.292 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.529 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -54.05 -11.48 0.46 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.092 0.473 . . . . 0.0 111.183 -179.889 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.469 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -81.82 -20.67 38.57 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.779 179.654 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -132.97 11.38 4.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.107 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.04 -42.11 2.04 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.809 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.408 ' HD3' ' CB ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -112.44 -14.82 13.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.362 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 ttm180 -51.78 -30.84 24.52 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.069 0.461 . . . . 0.0 110.399 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.3 -48.05 18.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.17 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.3 -33.52 73.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.231 0.538 . . . . 0.0 109.817 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.803 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 5.1 mt -67.88 -57.27 6.52 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.515 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.46 -23.72 10.91 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.244 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.97 -27.67 23.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.387 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -111.08 29.49 7.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.785 0.326 . . . . 0.0 111.286 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.506 ' HG ' HD11 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -132.7 -56.33 0.94 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.239 0.542 . . . . 0.0 110.673 179.75 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 121.11 3.28 10.75 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.494 -0.776 . . . . 0.0 112.009 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.537 ' HB3' ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -94.22 -158.66 0.64 Allowed 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.329 0.585 . . . . 0.0 111.234 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.414 ' HB3' HE22 ' A' ' 44' ' ' GLN . 33.6 t30 -119.06 -59.82 1.81 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.494 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.403 ' O ' ' HB ' ' A' ' 45' ' ' ILE . 1.4 mt-10 174.72 -42.2 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.925 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -72.52 -12.04 60.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.288 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.59 ' NE2' ' H ' ' A' ' 44' ' ' GLN . 1.4 mp0 -101.28 -15.78 17.17 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.931 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 2.7 mm -63.02 -58.74 6.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.765 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.457 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.465 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 2.6 mtmt -56.97 -19.09 16.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.047 178.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.925 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -78.12 -47.25 25.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 113.75 1.019 . . . . 0.0 113.75 -178.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.931 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 40.9 p-90 -65.53 -25.06 67.28 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 119.171 -1.012 . . . . 0.0 112.176 -177.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.683 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 23.3 m-85 -69.14 -53.96 17.4 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 176.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.559 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.4 pt20 -57.04 -28.52 62.59 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.9 179.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 N--CA 1.453 -0.302 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.883 178.653 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.549 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.8 OUTLIER . . . . . 0 CA--C 1.519 -0.218 0 CA-C-O 121.887 0.851 . . . . 0.0 109.632 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.95 -27.91 12.69 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.288 -1.324 . . . . 0.0 110.868 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.513 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.0 p90 -107.45 -44.81 4.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.85 -178.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.549 HD21 ' HA ' ' A' ' 23' ' ' ASN . 1.1 pp -50.61 -26.21 5.09 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.237 0.541 . . . . 0.0 110.601 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.462 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 1.2 p -65.39 -19.5 65.97 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.331 -0.849 . . . . 0.0 109.768 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -133.73 7.44 3.79 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.248 178.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.428 ' N ' ' O ' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -110.81 -50.37 2.96 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.394 179.99 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.412 ' HG2' ' HB2' ' A' ' 26' ' ' LEU . 7.4 ptm180 -117.74 -9.02 10.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.207 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.492 ' HG3' HG21 ' A' ' 45' ' ' ILE . 4.5 ttp85 -54.08 -27.91 35.75 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.968 0.413 . . . . 0.0 110.589 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -82.65 -27.63 31.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.628 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.52 -40.1 43.84 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.921 179.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.867 ' O ' HD22 ' A' ' 38' ' ' LEU . 0.2 OUTLIER -64.25 -59.5 4.33 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.574 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.595 ' CB ' HD11 ' A' ' 45' ' ' ILE . 32.6 t -38.75 -32.82 0.09 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.353 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.7 m -80.49 -27.1 37.86 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.448 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.584 ' N ' ' O ' ' A' ' 34' ' ' LEU . 8.9 tm-20 -73.74 -61.26 1.9 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.884 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 1.105 HD23 HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -53.88 -53.25 55.15 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.105 0.478 . . . . 0.0 110.396 179.783 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.55 36.09 1.64 Allowed Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.595 -179.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 1.105 HD11 HD23 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -117.57 -160.53 0.78 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.144 0.497 . . . . 0.0 111.398 -179.442 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -118.62 -101.32 0.43 Allowed 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.645 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -128.14 -44.22 1.45 Allowed 'General case' 0 C--O 1.231 0.098 0 CA-C-O 120.689 0.281 . . . . 0.0 111.636 -179.237 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.925 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -72.56 -2.79 21.21 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.788 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.5 ' NE2' ' H ' ' A' ' 44' ' ' GLN . 0.8 OUTLIER -106.57 -21.99 12.9 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.347 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.899 HG22 ' HE2' ' A' ' 49' ' ' PHE . 42.1 mm -58.03 -61.57 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 178.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.41 ' HG3' HD12 ' A' ' 47' ' ' ILE . 14.6 ptpt -57.68 -16.45 10.78 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.667 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.925 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -76.3 -39.96 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -178.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.864 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -74.23 -41.44 61.33 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 118.797 -1.161 . . . . 0.0 111.846 -179.111 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.899 ' HE2' HG22 ' A' ' 45' ' ' ILE . 2.1 m-85 -57.57 -34.3 69.06 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 119.425 -0.91 . . . . 0.0 108.968 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -50.79 -28.22 8.85 Favored 'General case' 0 C--O 1.231 0.081 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.948 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 . . . . . 0 N--CA 1.453 -0.283 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.264 179.149 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.546 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 2.9 m120 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 121.193 0.521 . . . . 0.0 110.231 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.23 -44.55 1.88 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.365 -178.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.441 ' H ' ' HD1' ' A' ' 25' ' ' TYR . 3.5 p90 -88.19 -34.17 17.9 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.135 -178.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.546 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER -55.26 -8.94 0.36 Allowed 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.233 -179.861 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.462 HG23 HD23 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -91.52 11.34 24.4 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.179 179.839 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.72 -42.35 0.07 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.212 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.84 -55.43 4.99 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.452 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.531 ' HD3' HD12 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -89.07 -20.63 24.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.725 179.6 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.883 ' HD2' HG21 ' A' ' 45' ' ' ILE . 0.6 OUTLIER -59.44 -43.64 93.09 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.645 179.838 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -64.69 -29.01 70.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.944 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.448 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.21 -40.02 38.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.777 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.681 HD13 ' CZ3' ' A' ' 48' ' ' TRP . 10.8 mt -70.37 -59.04 3.1 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.836 ' OG ' HD11 ' A' ' 45' ' ' ILE . 2.2 t -39.51 -33.15 0.15 Allowed 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.38 178.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.82 -38.23 46.8 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.517 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 34' ' ' LEU . 5.4 mt-10 -88.88 -18.8 26.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.51 -179.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.741 ' HB3' HD22 ' A' ' 40' ' ' LEU . 4.2 mm? -89.11 -1.06 57.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.63 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 48.93 69.3 1.03 Allowed Glycine 0 C--N 1.335 0.487 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.876 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.741 HD22 ' HB3' ' A' ' 38' ' ' LEU . 1.8 pt? -154.22 -150.85 0.34 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.357 0.598 . . . . 0.0 111.676 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -136.1 -89.71 0.3 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.692 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.485 ' HA ' HG13 ' A' ' 45' ' ' ILE . 2.5 tt0 -137.08 -46.9 0.58 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.798 0.332 . . . . 0.0 111.541 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.446 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -65.23 -19.61 66.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.685 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.788 ' HA ' HD13 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -95.36 -18.57 20.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.984 0.421 . . . . 0.0 110.105 179.775 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.926 HD13 ' CZ2' ' A' ' 48' ' ' TRP . 7.7 mm -54.71 -47.47 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.455 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -68.39 -10.59 56.14 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.789 178.172 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.788 HD13 ' HA ' ' A' ' 44' ' ' GLN . 1.1 mp -73.57 -32.34 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.381 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.926 ' CZ2' HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -71.44 -54.45 10.61 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.557 179.513 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.856 ' HE2' HG22 ' A' ' 45' ' ' ILE . 1.5 m-85 -64.09 -39.12 93.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.667 -178.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.46 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 3.6 pt20 -58.95 -24.93 63.07 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.316 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.471 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.567 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 121.092 0.472 . . . . 0.0 110.463 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -133.69 -32.72 1.11 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.664 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.503 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 16.7 p90 -105.09 -45.38 4.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.255 -0.429 . . . . 0.0 112.151 -178.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.572 HD23 ' H ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -46.34 -35.23 5.2 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.656 0.741 . . . . 0.0 109.939 -179.696 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.449 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -51.52 -25.78 7.29 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.11 178.629 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -136.05 24.61 3.3 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.326 179.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.22 -52.03 0.96 Allowed 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.992 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.503 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -133.06 18.24 4.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.342 179.963 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 26' ' ' LEU . 44.0 ttp85 -67.38 -41.67 84.64 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.188 0.518 . . . . 0.0 109.8 179.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -43.0 91.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.226 179.374 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.53 -32.51 68.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.181 0.515 . . . . 0.0 109.912 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.8 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 5.8 mt -67.39 -57.85 5.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.338 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.4 t -51.25 -25.88 6.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.168 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.0 m -91.46 -20.34 21.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.416 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -114.34 27.77 9.24 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.812 0.339 . . . . 0.0 111.024 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.49 ' HG ' HD11 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -134.27 -59.57 0.82 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.122 0.487 . . . . 0.0 110.633 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 128.22 -6.96 6.76 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.754 -179.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.49 HD11 ' HG ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -91.27 -158.66 0.57 Allowed 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.288 0.566 . . . . 0.0 111.065 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.401 ' H ' ' NE2' ' A' ' 44' ' ' GLN . 0.9 OUTLIER -118.93 -71.67 0.73 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.262 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.405 ' HA ' HG13 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -169.68 -44.31 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.971 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -64.41 -18.58 64.84 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.999 178.447 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.444 ' HB2' ' HB3' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -98.82 -17.71 18.31 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.817 178.916 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.933 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 3.5 mm -62.22 -59.29 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.567 178.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.501 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 6.6 pttt -56.68 -18.74 13.32 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.22 178.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.971 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -79.09 -48.84 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 -178.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.933 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 44.1 p-90 -64.39 -25.38 67.99 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 119.373 -0.931 . . . . 0.0 112.323 -177.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.703 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 27.0 m-85 -66.94 -52.8 38.59 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 177.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -56.23 -27.3 54.44 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.997 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 . . . . . 0 N--CA 1.452 -0.332 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.842 178.834 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.826 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.455 -0.204 0 CA-C-O 121.604 0.716 . . . . 0.0 110.361 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.411 ' HG3' ' N ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -99.5 -43.25 6.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.422 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.52 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 12.4 p90 -79.75 -44.25 21.07 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.656 -1.157 . . . . 0.0 111.79 -179.042 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.826 HD21 ' HA ' ' A' ' 23' ' ' ASN . 0.5 OUTLIER -50.05 -27.62 5.86 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.342 0.592 . . . . 0.0 110.319 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.475 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 2.3 p -61.37 -20.24 62.79 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.725 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -136.37 12.35 3.26 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.521 179.05 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.84 -29.97 4.21 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.042 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.451 ' HG3' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -146.64 20.25 1.32 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.784 179.886 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.475 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 2.3 ttt180 -88.57 -44.0 10.97 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 121.044 0.449 . . . . 0.0 109.813 179.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -59.75 -28.85 67.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.817 -0.628 . . . . 0.0 109.799 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.511 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -67.73 -34.87 77.69 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.271 179.421 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.006 HD23 HD21 ' A' ' 38' ' ' LEU . 0.9 OUTLIER -71.97 -61.41 1.8 Allowed 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.431 179.295 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.48 ' HA ' HD12 ' A' ' 40' ' ' LEU . 10.7 t -44.72 -29.5 0.78 Allowed 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.878 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.52 -26.43 18.78 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.179 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 34' ' ' LEU . 4.3 tt0 -106.04 20.11 19.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.786 0.327 . . . . 0.0 110.88 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 1.006 HD21 HD23 ' A' ' 34' ' ' LEU . 2.7 mm? -118.72 -43.43 2.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.39 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 99.31 34.87 4.92 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.669 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.822 HD13 HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -123.93 -159.6 0.87 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.23 0.538 . . . . 0.0 111.646 -179.378 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.51 -84.82 0.65 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.794 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -147.07 -46.9 0.18 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.859 0.361 . . . . 0.0 110.681 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.987 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -67.6 -11.68 58.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.265 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.529 ' NE2' ' H ' ' A' ' 44' ' ' GLN . 0.1 OUTLIER -97.65 -19.89 17.98 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.004 0.43 . . . . 0.0 109.969 179.222 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.822 HD13 HD13 ' A' ' 40' ' ' LEU . 44.8 mm -56.69 -61.39 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.668 178.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -59.58 -14.76 14.59 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.822 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.987 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -77.73 -37.58 24.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -178.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.826 ' CZ3' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -76.52 -33.41 58.6 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 118.505 -1.278 . . . . 0.0 111.975 -179.154 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.789 ' CZ ' ' CZ3' ' A' ' 48' ' ' TRP . 5.4 m-85 -66.94 -42.68 84.88 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 119.675 -0.81 . . . . 0.0 109.09 178.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.526 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 6.3 pt20 -62.84 -31.27 72.25 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 . . . . . 0 N--CA 1.452 -0.326 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.642 178.666 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.771 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.462 0.134 0 CA-C-O 121.145 0.497 . . . . 0.0 110.762 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.14 -38.34 1.23 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.12 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.557 ' CE1' HD23 ' A' ' 26' ' ' LEU . 19.6 p90 -94.27 -44.98 7.7 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.596 -178.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.771 HD21 ' HA ' ' A' ' 23' ' ' ASN . 0.3 OUTLIER -49.29 -29.64 6.25 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.358 0.599 . . . . 0.0 110.102 -179.564 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.412 ' H ' HG23 ' A' ' 27' ' ' THR . 1.2 p -57.79 -22.04 45.06 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.114 178.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -133.42 10.18 4.06 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.611 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -123.79 -40.65 2.3 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-O 120.969 0.414 . . . . 0.0 110.921 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.57 -12.51 10.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.085 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.683 ' CD ' HG21 ' A' ' 45' ' ' ILE . 3.6 ttt180 -56.96 -23.74 47.91 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.848 0.356 . . . . 0.0 110.81 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.01 -19.37 40.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.281 179.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.51 -46.24 11.04 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.27 179.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.893 HD22 ' CH2' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -63.51 -59.14 5.03 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.914 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.604 ' CB ' HD11 ' A' ' 45' ' ' ILE . 29.5 t -39.38 -32.76 0.13 Allowed 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.356 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.5 -27.82 41.44 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.194 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 34' ' ' LEU . 0.6 OUTLIER -73.39 -60.84 2.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.889 179.899 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 1.159 HD23 HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -56.29 -53.44 57.21 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.099 0.476 . . . . 0.0 110.41 179.846 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 114.12 43.15 0.8 Allowed Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.723 -179.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 1.159 HD11 HD23 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -129.63 -160.93 1.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.992 0.425 . . . . 0.0 111.398 -179.383 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.43 ' OD1' ' N ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -119.46 -91.58 0.55 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.16 -179.299 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.419 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 1.2 mp0 -136.77 -45.7 0.59 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.765 0.317 . . . . 0.0 111.333 -179.165 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.961 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -66.36 -11.76 52.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.265 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.523 ' NE2' ' H ' ' A' ' 44' ' ' GLN . 0.4 OUTLIER -103.39 -21.33 13.82 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.464 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.904 HG22 ' HE2' ' A' ' 49' ' ' PHE . 42.5 mm -57.41 -61.14 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.473 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 9.4 ttmt -57.56 -17.0 11.73 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.757 178.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.961 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -77.3 -34.83 21.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 -178.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.893 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -79.83 -32.4 40.62 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 118.685 -1.206 . . . . 0.0 111.611 -179.488 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.904 ' HE2' HG22 ' A' ' 45' ' ' ILE . 3.7 m-85 -65.71 -41.49 92.24 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 119.655 -0.818 . . . . 0.0 109.179 178.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.474 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 5.1 pt20 -61.36 -26.33 67.75 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 121.075 0.464 . . . . 0.0 109.805 179.25 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.924 178.939 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.55 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 121.248 0.547 . . . . 0.0 109.803 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.45 -38.12 2.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.745 -178.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.429 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 8.8 p90 -92.68 -36.99 12.64 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.397 -178.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.55 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -53.94 -9.98 0.29 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.331 -179.944 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.527 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.5 OUTLIER -83.16 -22.69 33.2 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.649 179.617 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -133.09 16.04 4.18 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.069 178.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.0 tpt180 -121.26 -55.97 1.93 Allowed 'General case' 0 C--O 1.231 0.099 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.503 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.424 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -120.07 4.1 10.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.135 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.527 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.3 OUTLIER -56.86 -28.37 61.65 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 121.009 0.433 . . . . 0.0 110.318 179.454 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -79.13 -20.41 48.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.171 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.23 -44.99 11.04 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.663 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.831 HD22 HD21 ' A' ' 38' ' ' LEU . 0.6 OUTLIER -57.77 -45.82 85.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.787 179.107 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.557 ' HA ' HD11 ' A' ' 45' ' ' ILE . 1.8 t -48.01 -26.64 1.86 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.093 179.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.47 -10.58 21.99 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.509 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -76.3 -61.83 1.82 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.745 0.307 . . . . 0.0 111.062 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.931 HD23 ' CD1' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -71.36 -47.27 57.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.117 0.484 . . . . 0.0 110.239 179.66 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 123.35 4.47 8.3 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.465 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.931 ' CD1' HD23 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -106.71 -167.99 1.36 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.955 0.407 . . . . 0.0 111.208 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.611 ' O ' HG12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -113.8 171.62 7.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.894 -179.888 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.47 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 49.5 mt-10 -52.78 -39.0 61.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.575 -179.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.931 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -56.72 -23.5 42.86 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.316 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.548 ' HA ' ' HB ' ' A' ' 47' ' ' ILE . 0.8 OUTLIER -107.66 -21.77 12.75 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.666 179.687 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.935 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 10.8 mm -57.32 -57.79 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.28 179.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.444 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -59.84 -20.05 54.65 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.151 178.093 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.931 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.4 mp -79.2 -46.73 23.22 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -178.375 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.935 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 25.2 p-90 -66.54 -30.17 70.42 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 119.003 -1.079 . . . . 0.0 111.958 -177.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.747 ' HE2' HG22 ' A' ' 45' ' ' ILE . 21.5 m-85 -64.17 -53.52 48.09 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 177.083 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 10.4 pt20 -56.72 -25.65 55.0 Favored 'General case' 0 N--CA 1.457 -0.087 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.109 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.2 m-20 . . . . . 0 N--CA 1.454 -0.272 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.216 179.135 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.476 ' O ' ' CG ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER . . . . . 0 CA--C 1.539 0.542 0 CA-C-O 120.98 0.419 . . . . 0.0 111.039 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.972 ' O ' HG23 ' A' ' 27' ' ' THR . 0.0 OUTLIER -138.22 -59.29 0.64 Allowed 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.354 0.597 . . . . 0.0 110.575 179.792 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.501 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 1.6 p90 -45.6 -29.87 1.33 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.013 179.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.56 HD23 ' C ' ' A' ' 24' ' ' ARG . 2.6 pt? -57.26 -10.8 1.41 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.76 -178.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.972 HG23 ' O ' ' A' ' 24' ' ' ARG . 1.3 p -93.51 -5.77 48.32 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.301 0.572 . . . . 0.0 109.63 179.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -148.51 22.35 1.03 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.015 179.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.408 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -151.59 -39.09 0.12 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.214 -179.524 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.417 ' H ' ' HA ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -128.9 32.2 4.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.024 179.645 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.556 ' HB3' ' HA ' ' A' ' 27' ' ' THR . 0.0 OUTLIER -96.58 -25.38 15.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.759 -179.7 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -99.62 -8.22 24.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.131 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.99 -38.68 8.49 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 178.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.994 HD21 ' CZ2' ' A' ' 48' ' ' TRP . 3.6 tt -68.01 -52.72 32.42 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.271 -1.331 . . . . 0.0 109.254 178.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.578 ' HA ' HD11 ' A' ' 38' ' ' LEU . 10.7 t -58.75 -20.71 51.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.443 179.066 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 75.2 m -91.1 -16.84 27.16 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.47 ' HG3' ' HG ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -100.82 23.56 10.42 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.381 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.892 HD13 HD12 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -166.94 16.39 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.617 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 45.59 32.89 4.33 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.025 -0.607 . . . . 0.0 113.351 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.933 HD13 ' CE2' ' A' ' 48' ' ' TRP . 11.6 mt -99.87 142.94 30.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.86 0.362 . . . . 0.0 110.43 179.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.473 ' O ' HG12 ' A' ' 45' ' ' ILE . 0.7 OUTLIER -68.41 141.14 55.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.247 -179.541 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.99 -33.76 18.89 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 121.184 0.516 . . . . 0.0 110.428 179.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.841 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -80.46 -33.01 37.03 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.778 0.799 . . . . 0.0 109.739 178.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.632 ' NE2' HD22 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -77.44 -16.38 58.82 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.457 -179.635 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.783 HG22 ' HE2' ' A' ' 49' ' ' PHE . 16.7 mm -62.43 -49.28 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.003 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 22.3 mtmt -70.86 -4.39 24.05 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.946 178.209 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.841 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.5 mp -86.45 -32.92 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -178.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.994 ' CZ2' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.81 -44.99 21.89 Favored 'General case' 0 N--CA 1.461 0.078 0 C-N-CA 118.113 -1.435 . . . . 0.0 111.141 179.689 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.783 ' HE2' HG22 ' A' ' 45' ' ' ILE . 6.0 m-85 -55.52 -43.86 76.13 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 120.104 -0.638 . . . . 0.0 109.625 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.49 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 4.6 pt20 -61.47 -24.77 66.8 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.177 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.355 179.294 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.435 ' O ' ' HG2' ' A' ' 24' ' ' ARG . 0.6 OUTLIER . . . . . 0 N--CA 1.461 0.124 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.677 ' O ' HG23 ' A' ' 27' ' ' THR . 0.5 OUTLIER -146.92 -46.01 0.18 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.761 0.791 . . . . 0.0 109.925 179.521 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.487 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 4.2 p90 -54.78 -38.2 66.97 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.596 -1.184 . . . . 0.0 110.337 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.51 HD23 ' H ' ' A' ' 26' ' ' LEU . 1.9 pt? -53.15 -26.77 18.16 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.696 -179.301 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.677 HG23 ' O ' ' A' ' 24' ' ' ARG . 6.6 p -67.01 -17.68 65.03 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.418 178.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -135.75 19.07 3.28 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.783 178.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.46 -46.71 1.75 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.664 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.412 ' HG3' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -135.8 11.33 3.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.499 179.993 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.475 ' N ' ' O ' ' A' ' 26' ' ' LEU . 1.4 ttm180 -64.66 -34.65 78.79 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.124 0.488 . . . . 0.0 110.111 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -76.91 -10.2 59.21 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.962 179.052 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.85 -15.24 16.28 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.817 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.785 ' O ' HD13 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -102.0 -3.1 28.26 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.47 179.513 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.654 ' HA ' HD11 ' A' ' 45' ' ' ILE . 3.1 t -112.79 -3.18 14.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.637 179.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -116.27 -23.21 8.49 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.237 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.544 ' C ' HD12 ' A' ' 38' ' ' LEU . 0.7 OUTLIER -91.3 15.52 11.86 Favored 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 111.736 0.272 . . . . 0.0 111.736 -179.72 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.831 ' N ' HD12 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -158.89 23.11 0.21 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.721 0.296 . . . . 0.0 111.224 -179.08 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 53.2 22.61 14.63 Favored Glycine 0 CA--C 1.518 0.254 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.941 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.746 HD12 HD13 ' A' ' 38' ' ' LEU . 6.4 mt -89.75 -171.39 3.16 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.008 0.432 . . . . 0.0 110.828 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.524 ' O ' HG12 ' A' ' 45' ' ' ILE . 1.7 t30 -133.47 140.29 47.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.418 178.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -46.97 -27.97 1.47 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.086 0.47 . . . . 0.0 110.948 -179.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.586 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -78.85 -40.42 32.71 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.461 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.597 ' HA ' HD13 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -84.64 -11.8 55.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.353 -179.473 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.845 HG22 ' CE2' ' A' ' 49' ' ' PHE . 20.4 mm -55.77 -52.96 42.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.639 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.552 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 38.4 mtmt -63.3 -16.26 59.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.248 177.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.597 HD13 ' HA ' ' A' ' 44' ' ' GLN . 1.3 mp -79.94 -44.4 22.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -178.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.755 ' CZ2' HD22 ' A' ' 34' ' ' LEU . 13.3 p-90 -71.36 -27.38 63.31 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 118.645 -1.222 . . . . 0.0 111.95 -178.284 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.845 ' CE2' HG22 ' A' ' 45' ' ' ILE . 23.0 m-85 -66.25 -51.07 61.16 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 177.01 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.492 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.3 pt20 -58.05 -25.84 61.72 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.021 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 . . . . . 0 N--CA 1.453 -0.29 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.017 179.013 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.742 ' HA ' HD21 ' A' ' 26' ' ' LEU . 9.6 m120 . . . . . 0 N--CA 1.465 0.293 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.1 ttm180 -138.29 -34.02 0.66 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 -177.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.591 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 13.3 p90 -110.47 -50.25 2.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.724 0.297 . . . . 0.0 111.368 -178.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.742 HD21 ' HA ' ' A' ' 23' ' ' ASN . 1.4 pt? -45.64 -34.61 3.55 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.364 0.602 . . . . 0.0 110.005 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.44 ' HB ' ' NH1' ' A' ' 31' ' ' ARG . 1.1 p -52.07 -25.69 9.27 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.884 178.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -132.1 27.94 4.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.878 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.99 -46.28 0.35 Allowed 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.016 -179.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.517 ' HG2' ' O ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -113.14 -18.27 12.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.011 -179.627 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.44 ' NH1' ' HB ' ' A' ' 27' ' ' THR . 5.6 ttm180 -50.46 -30.97 13.91 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.049 0.452 . . . . 0.0 110.553 179.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -72.95 -35.12 66.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.192 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.472 ' HG3' ' HG2' ' A' ' 30' ' ' ARG . 0.5 OUTLIER -74.29 -37.63 63.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.021 179.34 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.894 ' O ' HD22 ' A' ' 38' ' ' LEU . 5.8 mt -64.22 -50.09 69.39 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.928 179.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.7 t -45.69 -28.7 1.06 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.263 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -97.22 -14.1 21.62 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.74 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.505 ' HB3' HD13 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -84.66 -66.56 0.88 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.6 0.238 . . . . 0.0 111.258 -179.713 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.916 HD23 ' CD1' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -60.25 -50.12 74.93 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.033 0.444 . . . . 0.0 110.65 -179.919 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 127.5 -1.93 7.04 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.359 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.916 ' CD1' HD23 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -96.48 -161.75 0.9 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.913 0.387 . . . . 0.0 110.944 179.867 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.406 ' HB3' HE22 ' A' ' 44' ' ' GLN . 34.3 t30 -112.26 -100.75 0.41 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.519 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -133.21 -47.45 0.84 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.779 0.323 . . . . 0.0 110.916 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.991 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -60.97 -14.79 25.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.894 179.336 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.578 ' NE2' ' H ' ' A' ' 44' ' ' GLN . 0.8 OUTLIER -102.32 -20.65 14.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.266 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.885 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 8.4 mm -60.42 -59.61 3.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.635 178.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.454 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 15.9 mtmt -58.11 -17.82 20.91 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.26 178.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.991 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.4 mp -80.26 -43.21 21.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -178.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.885 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 32.4 p-90 -70.72 -26.95 63.63 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 118.904 -1.119 . . . . 0.0 112.197 -177.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.764 ' HE2' HG22 ' A' ' 45' ' ' ILE . 10.8 m-85 -67.97 -49.33 62.34 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.184 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.9 pt20 -59.35 -25.67 64.42 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.996 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 . . . . . 0 N--CA 1.454 -0.259 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.946 178.869 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.543 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 1.1 m-80 . . . . . 0 C--O 1.232 0.136 0 CA-C-O 121.106 0.479 . . . . 0.0 109.986 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.95 -33.44 3.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.209 -178.019 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.483 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.2 p90 -100.24 -38.67 8.4 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.524 -178.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.57 HD23 HG23 ' A' ' 27' ' ' THR . 0.5 OUTLIER -54.1 -9.77 0.29 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.346 -179.77 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.57 HG23 HD23 ' A' ' 26' ' ' LEU . 1.0 OUTLIER -84.8 -16.71 40.54 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.871 179.77 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -138.8 15.07 2.69 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.315 179.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.13 -48.14 2.12 Favored 'General case' 0 CA--C 1.522 -0.103 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.379 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.402 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.5 OUTLIER -126.36 2.7 7.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.13 179.654 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.543 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.0 OUTLIER -60.41 -21.25 62.01 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 120.98 0.419 . . . . 0.0 110.741 179.391 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -88.34 -32.92 18.17 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 179.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.28 -36.31 79.18 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.851 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.819 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 12.7 mt -67.12 -60.64 2.45 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.837 179.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.2 t -50.48 -24.85 3.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.392 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 98.9 p -92.66 -33.78 14.23 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.676 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.41 24.39 9.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.707 0.289 . . . . 0.0 111.601 -179.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.714 HD21 ' CD2' ' A' ' 34' ' ' LEU . 1.8 mm? -128.1 -53.87 1.29 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.265 0.555 . . . . 0.0 110.507 179.599 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.71 -3.46 13.37 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.586 -178.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.476 HD13 ' HE1' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -94.92 -160.09 0.76 Allowed 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.399 0.618 . . . . 0.0 111.228 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.406 ' ND2' ' HG3' ' A' ' 42' ' ' GLU . 25.1 t30 -117.55 -80.79 0.61 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.902 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.406 ' HG3' ' ND2' ' A' ' 41' ' ' ASN . 0.1 OUTLIER -160.04 -43.49 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 179.662 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.945 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -67.53 -12.74 61.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.382 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.587 ' NE2' ' H ' ' A' ' 44' ' ' GLN . 1.3 mp0 -102.19 -18.45 15.51 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.942 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 4.0 mm -62.21 -60.07 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.316 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.534 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -55.52 -19.69 10.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.22 178.332 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.945 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -77.85 -47.12 25.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -178.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.942 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 46.6 p-90 -67.67 -28.9 68.09 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 119.577 -0.849 . . . . 0.0 112.412 -177.361 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.719 ' HE2' HG22 ' A' ' 45' ' ' ILE . 17.5 m-85 -62.08 -43.79 98.07 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 177.348 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 47' ' ' ILE . 30.0 mt-30 -50.55 -34.08 24.2 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.04 179.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 . . . . . 0 N--CA 1.447 -0.614 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.071 179.581 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.841 ' HA ' HD22 ' A' ' 26' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 121.11 0.481 . . . . 0.0 110.659 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.12 -45.78 4.82 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.518 0.675 . . . . 0.0 110.897 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.509 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.8 p90 -76.18 -42.68 45.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.861 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.841 HD22 ' HA ' ' A' ' 23' ' ' ASN . 1.3 pt? -52.98 -22.12 5.26 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.101 0.477 . . . . 0.0 110.707 -179.063 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.583 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 2.7 p -64.72 -21.35 66.73 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.551 178.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -130.8 11.55 5.19 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.859 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.401 ' HB3' ' CD ' ' A' ' 30' ' ' ARG . 0.3 OUTLIER -110.61 -47.57 3.24 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.729 -179.885 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.594 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -144.62 14.7 1.58 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.741 179.695 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.583 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.1 OUTLIER -75.04 -35.69 61.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.016 0.436 . . . . 0.0 109.924 179.352 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.1 mp0 -61.39 -25.64 67.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.952 179.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.536 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -61.37 -37.33 83.0 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.072 179.446 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.788 HD13 ' HZ3' ' A' ' 48' ' ' TRP . 1.0 OUTLIER -73.52 -61.99 1.64 Allowed 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.226 178.705 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.475 ' HB2' HD12 ' A' ' 45' ' ' ILE . 19.7 t -45.65 -27.28 0.76 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.956 178.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.3 t -96.35 -17.47 20.63 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.765 -179.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 34' ' ' LEU . 22.8 mt-10 -121.52 20.52 11.12 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.753 0.311 . . . . 0.0 111.024 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.723 ' CB ' HD11 ' A' ' 40' ' ' LEU . 1.6 mm? -110.12 -55.56 2.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.25 0.548 . . . . 0.0 110.364 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 108.77 35.6 2.37 Favored Glycine 0 N--CA 1.448 -0.536 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.125 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.723 HD11 ' CB ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -122.2 -157.11 0.72 Allowed 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.192 0.52 . . . . 0.0 111.143 -179.165 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -126.11 -106.45 0.33 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.737 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -125.78 -40.1 2.08 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.883 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -77.66 1.89 18.43 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.522 ' NE2' ' N ' ' A' ' 44' ' ' GLN . 1.0 OUTLIER -108.42 -21.07 12.9 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.444 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.831 HG22 ' HE2' ' A' ' 49' ' ' PHE . 32.7 mm -57.39 -59.05 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.907 0 CA-C-O 121.271 0.558 . . . . 0.0 109.711 178.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt -61.09 -16.33 42.79 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.451 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.883 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -73.8 -38.68 51.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -178.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.788 ' HZ3' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -69.51 -47.86 62.43 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 118.92 -1.112 . . . . 0.0 111.235 -179.501 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.831 ' HE2' HG22 ' A' ' 45' ' ' ILE . 2.1 m-85 -63.32 -41.41 98.91 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 121.037 -0.265 . . . . 0.0 111.042 -179.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.527 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 5.0 pt20 -64.04 -26.17 68.44 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.177 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.345 179.155 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.596 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.158 0 CA-C-O 121.024 0.44 . . . . 0.0 110.741 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.76 -36.34 2.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.198 -179.549 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.514 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 25.2 p90 -96.93 -46.41 6.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.748 -178.635 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.596 HD21 ' HA ' ' A' ' 23' ' ' ASN . 0.2 OUTLIER -48.58 -31.27 6.33 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.516 0.674 . . . . 0.0 109.641 179.84 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.55 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 1.4 p -53.65 -24.7 15.08 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.951 178.496 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -133.65 17.69 3.93 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.997 178.769 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.436 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -120.33 -50.0 2.25 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.697 -179.869 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.42 6.59 3.82 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.577 179.99 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.662 ' CG ' HG21 ' A' ' 45' ' ' ILE . 47.4 ttt180 -75.62 -7.34 54.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.701 0.286 . . . . 0.0 111.182 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -94.66 -23.33 17.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.356 0.598 . . . . 0.0 109.484 178.901 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.82 -42.77 21.09 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.888 179.037 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.996 ' CD2' HD21 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -63.51 -58.91 5.49 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.045 179.064 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.513 ' CB ' HD11 ' A' ' 45' ' ' ILE . 32.8 t -41.74 -32.32 0.38 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.272 179.331 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.5 m -89.71 -33.06 16.74 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.846 179.83 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.403 ' N ' ' O ' ' A' ' 34' ' ' LEU . 36.0 tt0 -67.32 -14.75 63.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.467 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.996 HD21 ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -112.04 -44.93 3.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.776 0.322 . . . . 0.0 110.722 -179.763 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 109.73 46.07 0.93 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.912 179.475 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.904 HD11 HD13 ' A' ' 38' ' ' LEU . 0.4 OUTLIER -144.85 -168.51 2.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.755 0.312 . . . . 0.0 111.011 179.689 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.697 ' O ' HG12 ' A' ' 45' ' ' ILE . 4.9 p30 -129.7 -175.15 3.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.86 -179.722 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.521 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 9.0 mt-10 -49.23 -34.69 15.56 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -177.939 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.835 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -63.19 -23.18 67.31 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -178.814 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.558 ' HB2' HD22 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -112.03 -19.13 12.44 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 121.034 -0.266 . . . . 0.0 110.796 -179.272 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.907 HG22 ' HE2' ' A' ' 49' ' ' PHE . 38.8 mm -52.12 -60.73 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.845 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.454 ' HG3' HD12 ' A' ' 47' ' ' ILE . 34.6 pttt -59.21 -19.9 49.41 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.661 178.856 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.835 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.7 mp -78.63 -40.78 24.32 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -178.409 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.903 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -72.84 -31.94 65.11 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 118.513 -1.275 . . . . 0.0 112.296 -178.227 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.907 ' HE2' HG22 ' A' ' 45' ' ' ILE . 9.1 m-85 -66.4 -44.66 82.4 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 119.608 -0.837 . . . . 0.0 109.374 178.474 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.511 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 1.5 pt20 -58.63 -27.23 64.51 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.207 179.751 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.2 179.138 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.553 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.92 0.39 . . . . 0.0 110.562 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -126.79 -35.45 2.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.32 -178.078 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.418 ' C ' ' H ' ' A' ' 27' ' ' THR . 4.7 p90 -101.89 -34.94 9.19 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.379 -178.211 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.553 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -55.11 -10.12 0.49 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.068 179.725 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.525 HG23 HD23 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -86.73 -16.87 35.11 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.931 179.92 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -140.08 17.74 2.45 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.193 179.218 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -127.41 -53.15 1.37 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.826 -179.559 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.414 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.8 OUTLIER -121.76 3.98 10.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.449 -179.947 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.59 -38.69 69.74 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.069 0.461 . . . . 0.0 110.304 179.669 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -71.88 -46.42 57.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.246 179.253 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.48 -32.85 65.39 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.266 0.555 . . . . 0.0 109.932 179.087 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.822 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 5.0 mt -67.51 -55.95 11.49 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.686 179.845 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.642 ' HA ' HD11 ' A' ' 45' ' ' ILE . 3.8 t -59.34 -21.12 59.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.035 -179.76 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.0 t -95.26 -14.16 24.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.569 -179.643 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -106.12 -29.05 10.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.01 0.433 . . . . 0.0 110.507 179.843 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.603 ' CB ' HD11 ' A' ' 40' ' ' LEU . 4.0 mm? -78.89 -58.55 3.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.749 179.778 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 109.81 15.98 11.34 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.813 -179.114 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.603 HD11 ' CB ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -107.98 -162.64 0.84 Allowed 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.144 0.497 . . . . 0.0 111.361 -179.851 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.44 ' CB ' ' HB2' ' A' ' 44' ' ' GLN . 0.7 OUTLIER -97.3 146.79 24.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.337 -179.783 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -52.19 -36.7 52.65 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 121.218 0.532 . . . . 0.0 109.904 179.573 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.561 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -75.77 -33.97 60.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.104 178.239 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.557 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -75.82 -13.79 60.29 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.828 179.715 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.884 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 3.0 mm -65.53 -56.91 13.0 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.494 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.51 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.558 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 30.4 mtmt -54.45 -18.82 4.67 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.962 177.71 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.561 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -76.1 -46.19 34.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -178.851 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.884 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 34.4 p-90 -68.19 -28.21 67.06 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 119.553 -0.859 . . . . 0.0 112.651 -177.453 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.788 ' HE2' HG22 ' A' ' 45' ' ' ILE . 12.1 m-85 -63.61 -42.54 98.21 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.542 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -56.78 -33.54 66.76 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.679 179.147 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 . . . . . 0 N--CA 1.452 -0.357 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.126 179.204 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.54 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 121.273 0.559 . . . . 0.0 109.633 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.85 -42.12 2.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.146 -0.933 . . . . 0.0 111.453 -178.545 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.435 ' C ' ' H ' ' A' ' 27' ' ' THR . 6.9 p90 -88.92 -35.77 16.29 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.279 -178.692 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.54 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER -54.26 -9.02 0.24 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.15 0.5 . . . . 0.0 111.371 -179.891 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.484 HG23 HD23 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -88.01 -19.51 27.07 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.927 179.941 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -132.57 12.4 4.48 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.975 178.591 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.22 -44.44 1.14 Allowed 'General case' 0 C--O 1.231 0.098 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.111 179.981 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.427 ' HD3' ' CB ' ' A' ' 26' ' ' LEU . 14.9 mtp180 -110.97 -3.56 15.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.896 179.548 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -11.09 39.38 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.737 0.303 . . . . 0.0 111.066 179.773 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -95.91 -19.78 19.27 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.718 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -86.93 -47.89 8.61 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.994 179.234 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.965 HD22 ' CZ3' ' A' ' 48' ' ' TRP . 0.5 OUTLIER -61.66 -48.35 81.22 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.87 179.764 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.708 ' O ' HD12 ' A' ' 40' ' ' LEU . 6.1 t -50.49 -37.23 37.61 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.892 179.213 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.5 t -98.6 7.7 45.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.472 179.131 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.487 ' C ' HD12 ' A' ' 38' ' ' LEU . 11.5 tt0 -92.88 -38.48 11.7 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.583 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.758 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -107.82 19.57 19.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.353 -179.406 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 56.25 63.67 5.1 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.478 -0.867 . . . . 0.0 111.455 -179.185 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.734 HD13 ' HZ2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -137.93 -160.33 1.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.203 0.525 . . . . 0.0 111.952 -178.428 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.7 -83.89 0.17 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.001 179.97 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.432 ' HA ' HG12 ' A' ' 45' ' ' ILE . 6.0 mp0 -141.45 -39.54 0.39 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.898 0.38 . . . . 0.0 110.633 -179.588 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.836 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -66.44 -12.96 59.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.691 -179.953 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.514 ' HB2' ' HB3' ' A' ' 40' ' ' LEU . 1.3 mp0 -111.88 -26.26 9.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.804 0.335 . . . . 0.0 110.53 -179.914 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.819 HG22 ' HE1' ' A' ' 49' ' ' PHE . 8.9 mm -60.52 -64.06 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.747 0 CA-C-O 121.352 0.596 . . . . 0.0 110.24 179.574 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -55.72 -21.85 20.76 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.322 179.576 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.836 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -64.35 -35.96 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.229 -179.642 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.965 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -71.69 -58.61 3.33 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.485 179.686 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.819 ' HE1' HG22 ' A' ' 45' ' ' ILE . 0.4 OUTLIER -60.26 -25.48 65.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.703 -179.563 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -57.08 -29.95 63.91 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.066 0.46 . . . . 0.0 110.03 179.22 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.326 179.326 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.419 ' O ' HD21 ' A' ' 26' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.082 0 CA-C-O 121.214 0.531 . . . . 0.0 111.082 . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.646 ' O ' HG23 ' A' ' 27' ' ' THR . 24.0 mtm105 -100.26 -49.28 4.32 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.754 0.787 . . . . 0.0 110.412 179.853 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.518 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 4.7 p90 -47.75 -39.81 18.9 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.412 -1.267 . . . . 0.0 111.178 -179.876 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.518 ' N ' ' CG ' ' A' ' 25' ' ' TYR . 3.8 pp -51.19 -30.49 17.24 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.862 -179.074 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.646 HG23 ' O ' ' A' ' 24' ' ' ARG . 16.5 p -63.13 -19.27 64.3 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.3 -0.863 . . . . 0.0 109.832 179.163 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -131.94 8.05 4.41 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.481 178.748 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -113.27 -43.69 3.33 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.826 179.937 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.446 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -128.32 -1.36 5.67 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.616 179.853 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.827 ' NE ' HG21 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -72.9 -11.16 60.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.786 0.327 . . . . 0.0 110.981 179.702 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -102.66 -21.23 14.15 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.004 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -81.97 -41.14 21.2 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.112 179.294 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.65 HD13 ' CZ3' ' A' ' 48' ' ' TRP . 10.4 mt -67.79 -59.67 3.13 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.46 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.8 ' OG ' HD11 ' A' ' 45' ' ' ILE . 4.7 t -38.53 -32.94 0.09 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.675 178.756 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.8 t -81.06 -38.32 27.57 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.926 -179.334 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -86.95 -27.24 23.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.814 0.34 . . . . 0.0 111.473 -179.494 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.796 ' HB3' HD22 ' A' ' 40' ' ' LEU . 3.5 mm? -78.32 -2.93 40.45 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.643 -179.667 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 50.64 68.63 1.38 Allowed Glycine 0 C--N 1.334 0.469 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.608 179.884 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.796 HD22 ' HB3' ' A' ' 38' ' ' LEU . 1.9 pt? -153.21 -151.88 0.39 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.285 0.564 . . . . 0.0 111.694 -179.188 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -136.78 -84.12 0.35 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.804 -179.629 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.485 ' HA ' HG13 ' A' ' 45' ' ' ILE . 11.5 tt0 -141.01 -46.77 0.4 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.854 0.359 . . . . 0.0 111.487 -179.297 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.556 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -64.91 -17.43 64.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.716 -179.659 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.77 ' HA ' HD13 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -98.56 -18.14 18.31 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.271 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.937 HD13 ' CZ2' ' A' ' 48' ' ' TRP . 6.8 mm -55.35 -46.61 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 178.154 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.36 -10.76 59.36 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.869 -1.059 . . . . 0.0 109.755 178.099 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.77 HD13 ' HA ' ' A' ' 44' ' ' GLN . 1.2 mp -73.08 -33.2 41.85 Favored 'Isoleucine or valine' 0 C--N 1.342 0.277 0 C-N-CA 121.016 -0.274 . . . . 0.0 111.234 -179.926 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.937 ' CZ2' HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -70.87 -60.5 2.2 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.322 179.606 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.854 ' HE2' HG22 ' A' ' 45' ' ' ILE . 1.0 OUTLIER -58.84 -30.07 67.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.509 -179.735 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -51.0 -26.85 6.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.103 0.478 . . . . 0.0 109.938 178.961 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.201 179.106 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.409 ' HA ' HD22 ' A' ' 26' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.462 0.135 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.624 ' O ' HG23 ' A' ' 27' ' ' THR . 8.0 mmt180 -148.2 -46.22 0.16 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.774 0.797 . . . . 0.0 109.976 179.556 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.51 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 6.1 p90 -58.02 -39.05 77.39 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.546 -1.206 . . . . 0.0 110.248 179.811 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.573 ' HA ' ' HB3' ' A' ' 29' ' ' ARG . 2.1 pt? -52.67 -30.12 30.22 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.342 -179.564 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.624 HG23 ' O ' ' A' ' 24' ' ' ARG . 3.7 p -64.28 -18.33 64.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.661 178.918 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -137.04 19.91 3.0 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.078 178.829 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.573 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.7 OUTLIER -126.1 -41.57 1.92 Allowed 'General case' 0 C--O 1.231 0.11 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.089 -179.454 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.484 ' HD3' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -149.7 19.98 0.91 Allowed 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.766 0.284 . . . . 0.0 111.766 -179.781 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.532 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.6 OUTLIER -81.47 -26.11 35.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.858 0.361 . . . . 0.0 110.474 179.687 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -86.46 -21.65 26.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.173 179.145 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.5 -45.14 12.93 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.082 179.344 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.901 HD22 ' CH2' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -62.88 -57.65 10.08 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.814 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.584 ' CB ' HD11 ' A' ' 45' ' ' ILE . 29.9 t -40.53 -32.98 0.23 Allowed 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.186 179.718 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.36 -30.08 47.79 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.856 179.727 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.564 ' N ' ' O ' ' A' ' 34' ' ' LEU . 31.5 mt-10 -71.28 -57.13 4.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.811 179.812 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 1.054 HD23 HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.39 -47.43 85.47 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.125 0.488 . . . . 0.0 110.34 179.7 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.31 30.9 5.48 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.333 -178.837 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 1.054 HD11 HD23 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -126.61 -168.29 1.84 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.019 0.437 . . . . 0.0 111.343 -179.48 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.6 ' O ' HG12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -124.09 176.83 6.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.064 179.878 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.44 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 13.6 mp0 -46.85 -30.93 2.74 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.006 -178.675 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.712 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -63.63 -19.85 65.2 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.115 -179.481 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.663 ' CB ' HD22 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -118.72 -20.9 8.09 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.557 -179.023 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.875 HG22 ' HE2' ' A' ' 49' ' ' PHE . 46.9 mm -50.81 -58.08 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.473 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.431 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 1.5 mtmt -60.34 -25.08 65.55 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.481 178.391 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.712 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.6 mp -70.93 -39.31 75.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -178.585 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.901 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -74.45 -40.6 61.81 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 118.401 -1.32 . . . . 0.0 111.907 -178.859 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.875 ' HE2' HG22 ' A' ' 45' ' ' ILE . 2.8 m-85 -59.92 -33.74 72.27 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.347 -0.941 . . . . 0.0 108.663 178.025 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.4 ' NE2' ' O ' ' A' ' 46' ' ' LYS . 0.9 OUTLIER -49.32 -27.81 4.26 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.909 179.163 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.218 179.319 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.163 0 N-CA-C 112.524 -0.231 . . . . 0.0 112.524 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.7 -174.96 5.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.78 0.324 . . . . 0.0 110.909 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -136.8 46.63 2.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.815 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 15.5 tttp -177.09 66.18 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.819 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.7 mmp_? -114.64 149.28 42.03 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.946 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.37 -165.62 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.575 2.183 . . . . 0.0 112.235 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.09 48.96 1.77 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.529 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.646 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -135.7 -77.9 0.43 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.949 -179.684 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.646 ' H ' HG23 ' A' ' 6' ' ' THR . . . -67.76 -27.56 66.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.802 0.334 . . . . 0.0 110.782 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.777 ' CG ' HD21 ' A' ' 13' ' ' LEU . 0.0 OUTLIER 172.29 112.99 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.091 0.472 . . . . 0.0 111.06 179.606 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.502 ' O ' ' CB ' ' A' ' 10' ' ' SER . 0.0 OUTLIER -90.84 36.76 0.91 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.009 -179.563 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.502 ' CB ' ' O ' ' A' ' 9' ' ' SER . 5.5 t 90.35 -30.58 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.517 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -35.33 80.18 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.582 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.472 ' CB ' ' HB3' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -82.29 -31.07 30.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.797 178.885 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.777 HD21 ' CG ' ' A' ' 8' ' ' PHE . 11.7 mt -70.27 -34.23 72.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.972 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.62 -31.4 66.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.769 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -66.46 -35.37 80.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.776 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.64 68.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.83 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.683 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.2 OUTLIER -74.4 -59.1 2.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.19 179.491 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -29.36 60.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.084 178.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -63.03 -48.88 76.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.554 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.683 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.8 p90 -83.96 -25.55 29.97 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.657 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -53.73 -26.58 23.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.098 0.475 . . . . 0.0 109.881 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.712 ' C ' HD21 ' A' ' 26' ' ' LEU . 5.9 mt-10 -97.41 18.55 15.02 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.794 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.58 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -161.22 33.97 0.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.167 179.236 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.2 tpp180 -126.17 -35.59 2.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.228 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.493 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 20.5 p90 -100.58 -46.18 5.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.702 -178.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.712 HD21 ' C ' ' A' ' 22' ' ' GLU . 0.3 OUTLIER -48.69 -29.84 4.87 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.43 0.633 . . . . 0.0 110.0 -179.939 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.455 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.8 OUTLIER -55.2 -24.71 28.58 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.886 178.617 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.82 8.73 5.32 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.462 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.461 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.9 OUTLIER -112.58 -50.83 2.87 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.828 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.438 ' HD3' ' CB ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -119.93 -7.33 9.96 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.69 -179.797 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.525 ' NE ' HG21 ' A' ' 45' ' ' ILE . 10.2 ttt180 -53.44 -33.59 54.65 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.109 0.48 . . . . 0.0 110.389 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -74.03 -29.69 62.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.508 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.491 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -72.59 -38.95 67.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.461 179.807 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.72 ' HB3' ' CZ3' ' A' ' 48' ' ' TRP . 6.7 mt -70.86 -62.12 1.51 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.9 t -46.48 -29.45 1.76 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.913 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.9 m -73.81 -47.98 34.75 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.163 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.85 -10.7 56.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.024 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.691 ' HG ' ' CZ2' ' A' ' 48' ' ' TRP . 2.2 mm? -89.32 -27.73 20.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.661 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.64 65.51 3.38 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.925 -179.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.872 HD22 ' CB ' ' A' ' 44' ' ' GLN . 1.3 pp -157.34 -162.89 1.27 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.978 0.418 . . . . 0.0 111.312 -179.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.533 ' O ' HG12 ' A' ' 45' ' ' ILE . 19.4 m-20 -123.07 -177.68 3.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.611 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -58.36 -24.43 59.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.962 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.886 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -72.47 -4.9 33.14 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.872 ' CB ' HD22 ' A' ' 40' ' ' LEU . 0.9 OUTLIER -120.84 -25.7 5.37 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.951 0.405 . . . . 0.0 109.959 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 1.02 HG22 ' CE2' ' A' ' 49' ' ' PHE . 14.7 mm -57.36 -59.35 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.913 0 CA-C-O 121.661 0.743 . . . . 0.0 109.148 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.498 ' O ' ' CB ' ' A' ' 50' ' ' GLN . 0.2 OUTLIER -55.75 -29.42 59.52 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.528 -1.215 . . . . 0.0 110.144 179.612 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.886 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -59.39 -32.79 49.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.682 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.72 ' CZ3' ' HB3' ' A' ' 34' ' ' LEU . 1.5 m0 -69.97 -63.9 0.99 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.522 0.677 . . . . 0.0 110.112 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 1.02 ' CE2' HG22 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -62.31 -28.22 69.58 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.561 -179.441 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.498 ' CB ' ' O ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -62.96 -32.96 74.4 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 178.86 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -86.82 -28.66 22.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.022 178.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.5 tttm -76.21 -26.92 56.6 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.689 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 37.5 mtt180 -58.37 -30.9 67.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.77 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -87.85 -53.28 4.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.061 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.41 ' O ' ' HB ' ' A' ' 56' ' ' ILE . 1.7 tttt 59.82 31.06 20.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.968 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.41 ' HB ' ' O ' ' A' ' 55' ' ' LYS . 3.7 mt 79.41 68.94 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 121.243 0.544 . . . . 0.0 110.76 -179.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.48 ' O ' ' HG2' ' A' ' 58' ' ' ARG . 43.0 mtt-85 -153.14 -41.88 0.1 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.125 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 0.8 OUTLIER 36.03 53.77 0.93 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.833 -179.994 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.961 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.188 0 N-CA-C 112.517 -0.233 . . . . 0.0 112.517 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -117.54 115.87 25.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.798 0.332 . . . . 0.0 110.935 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.39 51.3 0.35 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.84 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.1 mttm -146.93 51.47 1.1 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.825 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.683 HH22 HD11 ' A' ' 13' ' ' LEU . 47.3 mtp180 -111.95 139.41 22.3 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.895 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -86.24 -167.02 0.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.626 2.217 . . . . 0.0 112.392 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -144.96 52.41 1.22 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.264 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.709 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -129.98 -77.84 0.54 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.064 -179.452 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.709 ' H ' HG23 ' A' ' 6' ' ' THR . . . -59.1 -41.48 88.21 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 120.818 0.342 . . . . 0.0 110.591 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.936 ' CD2' HD22 ' A' ' 13' ' ' LEU . 0.0 OUTLIER 179.11 109.15 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.435 179.546 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.544 ' O ' ' CB ' ' A' ' 10' ' ' SER . 0.0 OUTLIER -98.29 38.57 1.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.681 -179.685 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.758 ' H ' HD21 ' A' ' 13' ' ' LEU . 4.9 t 94.95 -29.85 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.988 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -79.2 -3.73 47.14 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.753 -179.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.37 -4.48 13.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.805 0.336 . . . . 0.0 111.051 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.936 HD22 ' CD2' ' A' ' 8' ' ' PHE . 0.1 OUTLIER -116.09 -27.71 6.83 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.219 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.78 -28.97 68.81 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.834 178.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.3 ttp-105 -70.35 -40.51 74.02 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.463 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.44 -40.79 95.75 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.744 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.621 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -59.26 -46.69 87.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.171 179.493 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -74.17 -32.13 62.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.313 179.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -44.87 92.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.897 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.621 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.8 OUTLIER -87.45 -23.15 24.56 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.921 179.916 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -54.13 -27.95 36.65 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.53 -14.51 42.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.513 179.12 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.77 ' HB2' HD11 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -126.2 43.95 2.97 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.503 0.668 . . . . 0.0 110.616 179.247 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.37 -35.51 7.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.572 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.521 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.7 p90 -92.19 -44.34 8.83 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.926 -1.033 . . . . 0.0 111.767 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.77 HD11 ' HB2' ' A' ' 23' ' ' ASN . 0.3 OUTLIER -46.32 -27.33 1.01 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.315 0.579 . . . . 0.0 110.969 -179.13 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.431 HG23 ' H ' ' A' ' 27' ' ' THR . 1.1 p -58.57 -19.73 40.68 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.105 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -123.85 -17.72 6.23 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.438 178.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.441 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 4.6 tmt_? -96.21 -53.08 3.75 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-O 120.948 0.404 . . . . 0.0 110.503 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.525 ' HB2' ' HB2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -82.41 -27.82 31.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.392 179.438 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.555 ' HG3' HG21 ' A' ' 45' ' ' ILE . 27.4 ttt180 -49.77 -29.91 8.59 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 178.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -77.62 -32.48 53.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.383 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.511 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.2 OUTLIER -77.84 -40.43 40.32 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.537 179.621 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.71 HD13 ' CZ3' ' A' ' 48' ' ' TRP . 1.5 mt -63.14 -54.05 43.78 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.082 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.1 t -41.72 -30.8 0.25 Allowed 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.734 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.3 m -120.52 14.97 11.99 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.459 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -105.85 -45.25 4.42 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.782 0.289 . . . . 0.0 111.782 -179.871 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 1.05 HD11 HD21 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -103.34 14.62 31.1 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -179.114 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.11 69.4 1.29 Allowed Glycine 0 CA--C 1.509 -0.343 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.577 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 1.05 HD21 HD11 ' A' ' 38' ' ' LEU . 0.9 OUTLIER -101.25 -164.91 1.15 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.859 0.362 . . . . 0.0 111.873 -179.251 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -126.55 16.55 7.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.038 -178.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.432 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 0.7 OUTLIER 66.9 7.81 5.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.67 0.271 . . . . 0.0 111.28 -179.841 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.783 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -117.62 -29.64 5.7 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.953 0.406 . . . . 0.0 110.533 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.516 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -88.43 -4.32 58.66 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.879 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.787 HG22 ' HE1' ' A' ' 49' ' ' PHE . 9.1 mm -60.41 -58.78 5.8 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.05 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.904 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.483 ' O ' ' HB2' ' A' ' 50' ' ' GLN . 13.8 pttt -62.17 -19.32 62.96 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.909 -1.041 . . . . 0.0 109.631 178.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.783 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.7 mp -67.34 -34.89 71.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.785 ' CH2' HG23 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -69.82 -60.21 2.45 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 119.903 -0.719 . . . . 0.0 110.238 179.832 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.787 ' HE1' HG22 ' A' ' 45' ' ' ILE . 1.4 m-85 -57.73 -29.78 65.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.385 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.672 ' O ' ' HB3' ' A' ' 54' ' ' ALA . 0.0 OUTLIER -51.79 -29.83 20.64 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.084 0.469 . . . . 0.0 110.074 178.94 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -86.33 -29.49 22.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.612 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.35 -21.46 42.39 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.069 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.81 36.36 4.54 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.805 0.336 . . . . 0.0 111.099 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.672 ' HB3' ' O ' ' A' ' 50' ' ' GLN . . . -162.12 -56.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.243 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.412 ' O ' ' HB ' ' A' ' 56' ' ' ILE . 23.2 ttmt -86.7 -67.59 0.8 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.995 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.412 ' HB ' ' O ' ' A' ' 55' ' ' LYS . 3.7 mt 78.56 68.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.185 0.517 . . . . 0.0 110.806 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.69 -46.18 0.17 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.681 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -56.83 -31.6 64.92 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.977 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.5 t . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.149 -0.929 . . . . 0.0 110.923 179.967 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.097 0 N-CA-C 112.532 -0.227 . . . . 0.0 112.532 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -125.9 23.63 7.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.771 0.32 . . . . 0.0 111.087 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 61.93 46.18 6.87 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.792 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -158.35 57.65 0.45 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.791 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -91.67 146.75 33.72 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.847 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.435 ' HB2' HG22 ' A' ' 6' ' ' THR . 56.4 Cg_endo -70.6 -165.6 0.18 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.516 2.144 . . . . 0.0 112.282 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.462 ' HA ' ' HB3' ' A' ' 9' ' ' SER . 0.0 OUTLIER -128.9 44.56 2.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.235 0.54 . . . . 0.0 110.487 179.795 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.558 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -107.71 -77.07 0.6 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.731 -179.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.558 ' H ' HG23 ' A' ' 6' ' ' THR . . . -68.3 -29.0 67.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.633 179.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.786 ' CG ' HD21 ' A' ' 13' ' ' LEU . 0.0 OUTLIER 172.11 114.31 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.178 0.513 . . . . 0.0 110.991 179.505 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.486 ' O ' ' CB ' ' A' ' 10' ' ' SER . 1.4 p -89.3 35.14 0.8 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.909 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.486 ' CB ' ' O ' ' A' ' 9' ' ' SER . 3.4 m 90.16 -30.68 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.484 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -64.86 -36.96 86.02 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.901 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.48 ' CB ' ' HB3' ' A' ' 8' ' ' PHE . 4.6 mt-30 -78.3 -29.65 47.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.934 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.786 HD21 ' CG ' ' A' ' 8' ' ' PHE . 11.2 mt -71.05 -33.43 70.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.063 179.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.3 -37.14 63.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.704 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.4 tmm_? -80.23 -38.89 30.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.622 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.08 -28.91 70.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.968 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.641 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.1 OUTLIER -58.77 -44.44 90.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.5 179.786 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.05 -31.95 56.58 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.504 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.37 -42.47 87.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.009 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.641 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.6 OUTLIER -87.98 -24.41 23.55 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.061 179.994 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -48.5 -54.45 14.27 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.955 0.407 . . . . 0.0 110.356 179.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.404 ' O ' ' CE1' ' A' ' 25' ' ' TYR . 1.3 mp0 -73.17 -20.87 60.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.397 179.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.517 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER -102.56 31.62 4.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.295 0.569 . . . . 0.0 109.715 179.505 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -121.83 -38.75 2.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.821 -178.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.45 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 13.0 p90 -89.95 -39.01 13.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.545 -178.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.517 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 1.0 OUTLIER -53.05 -14.63 0.64 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 121.107 0.48 . . . . 0.0 111.089 -179.742 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.44 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -77.5 -20.43 54.31 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.811 179.52 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -133.98 14.18 3.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.116 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.435 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -118.53 -42.73 2.74 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.821 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.72 9.61 3.36 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.411 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.612 ' HD3' HG21 ' A' ' 45' ' ' ILE . 1.7 ttm180 -71.59 -46.28 59.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.899 0.38 . . . . 0.0 110.624 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -61.95 -27.89 69.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.887 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.474 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -74.73 -39.46 61.86 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.594 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.686 HD13 ' CZ3' ' A' ' 48' ' ' TRP . 9.8 mt -69.13 -58.49 4.0 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.847 ' OG ' HD11 ' A' ' 45' ' ' ILE . 1.7 t -40.11 -33.22 0.21 Allowed 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.271 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.4 m -77.24 -39.02 49.92 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.303 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -91.18 -9.21 46.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.629 -179.765 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.718 ' HB3' HD22 ' A' ' 40' ' ' LEU . 4.3 mm? -99.03 2.93 46.68 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.607 0.242 . . . . 0.0 111.451 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 46.84 70.14 0.74 Allowed Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.992 -0.623 . . . . 0.0 113.072 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.765 HD11 HD13 ' A' ' 45' ' ' ILE . 1.8 pt? -156.66 -151.45 0.32 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.295 0.569 . . . . 0.0 111.659 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -136.55 -89.49 0.29 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.098 -0.956 . . . . 0.0 111.615 -179.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.46 ' HA ' HG13 ' A' ' 45' ' ' ILE . 14.0 mm-40 -136.97 -46.46 0.58 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.776 0.322 . . . . 0.0 111.605 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.578 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -66.11 -19.15 65.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.751 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.806 ' HA ' HD13 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -95.61 -17.07 21.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.973 0.416 . . . . 0.0 110.082 179.838 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.916 HD13 ' CZ2' ' A' ' 48' ' ' TRP . 8.3 mm -54.66 -49.48 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 178.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -66.38 -11.11 49.61 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.913 177.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.806 HD13 ' HA ' ' A' ' 44' ' ' GLN . 1.3 mp -73.67 -33.29 38.05 Favored 'Isoleucine or valine' 0 C--N 1.343 0.29 0 C-N-CA 121.034 -0.266 . . . . 0.0 111.553 -179.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.916 ' CZ2' HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -69.11 -60.1 2.58 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.312 179.661 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.793 ' HE2' HG22 ' A' ' 45' ' ' ILE . 1.3 m-85 -57.16 -33.27 67.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.695 -179.282 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.89 -30.15 61.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.08 0.467 . . . . 0.0 109.854 179.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -83.27 -30.22 27.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.997 179.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.87 -28.21 67.33 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.688 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -61.91 -32.95 73.38 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.924 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -90.73 -60.38 1.93 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.081 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.406 ' O ' ' HB ' ' A' ' 56' ' ' ILE . 2.7 mttp 63.76 26.27 14.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.133 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.406 ' HB ' ' O ' ' A' ' 55' ' ' LYS . 3.9 mt 78.94 68.76 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 121.167 0.508 . . . . 0.0 110.848 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.11 -49.2 0.15 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.852 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.99 85.19 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.872 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.4 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.914 -179.982 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 112.456 -0.258 . . . . 0.0 112.456 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -168.69 108.11 0.48 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.78 0.324 . . . . 0.0 110.886 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 63.31 47.08 4.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.786 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -170.3 47.97 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.894 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.1 mmt180 -133.11 146.91 63.11 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.95 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.546 ' HB2' HG22 ' A' ' 6' ' ' THR . 50.4 Cg_exo -54.8 -161.52 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.73 2.287 . . . . 0.0 112.48 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.6 ptp85 -127.55 43.71 3.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.544 179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.58 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -109.78 -76.59 0.61 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.978 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.58 ' H ' HG23 ' A' ' 6' ' ' THR . . . -74.21 -26.51 60.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.99 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.6 ' CD2' HD11 ' A' ' 13' ' ' LEU . 0.0 OUTLIER 170.94 113.23 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.019 0.438 . . . . 0.0 111.183 179.818 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.519 ' O ' ' CB ' ' A' ' 10' ' ' SER . 0.0 OUTLIER -95.28 38.58 1.14 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.334 -179.316 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.644 ' HA ' HD22 ' A' ' 13' ' ' LEU . 2.7 m 93.27 -31.0 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.831 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -19.83 65.45 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.173 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.449 ' HB2' ' CB ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -94.66 -44.3 7.88 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.211 179.52 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.644 HD22 ' HA ' ' A' ' 10' ' ' SER . 0.0 OUTLIER -60.76 -40.15 91.44 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.45 -21.43 37.0 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.693 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.88 -28.04 36.09 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.893 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -91.94 14.13 16.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.432 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.403 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.4 OUTLIER -137.09 0.94 2.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.397 179.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.0 ttp180 -145.76 -43.37 0.21 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.756 0.312 . . . . 0.0 110.686 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.64 -27.84 66.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.605 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.484 ' C ' ' CD1' ' A' ' 20' ' ' PHE . 0.8 OUTLIER -87.51 -26.7 23.05 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.788 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.449 ' O ' ' CD1' ' A' ' 25' ' ' TYR . 70.6 m-20 -73.22 -3.32 26.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.287 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -120.28 2.22 10.82 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.993 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.444 ' O ' ' CG ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -144.73 8.0 1.28 Allowed 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.89 0.376 . . . . 0.0 111.294 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.897 ' O ' HG23 ' A' ' 27' ' ' THR . 12.1 mtt180 -133.28 -55.95 0.91 Allowed 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.161 0.505 . . . . 0.0 110.69 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.485 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 1.3 p90 -37.78 -34.37 0.11 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.277 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.685 HD23 ' C ' ' A' ' 24' ' ' ARG . 2.2 pt? -51.58 -28.67 14.69 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.206 -178.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.897 HG23 ' O ' ' A' ' 24' ' ' ARG . 2.5 p -70.83 -14.96 62.6 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.972 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -136.92 15.68 3.07 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.09 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' A' ' 25' ' ' TYR . 16.4 tpt85 -121.62 -48.07 2.18 Favored 'General case' 0 C--O 1.23 0.055 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.579 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.401 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -119.91 -14.28 8.96 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.553 179.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.756 ' CG ' HG21 ' A' ' 45' ' ' ILE . 1.7 ttm180 -56.92 -22.49 37.96 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.672 0.273 . . . . 0.0 110.968 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -84.11 -25.17 29.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.048 0.451 . . . . 0.0 109.98 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.91 -44.09 15.77 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.044 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.858 ' O ' HD22 ' A' ' 38' ' ' LEU . 0.2 OUTLIER -64.35 -59.52 4.27 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 178.788 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.6 ' CB ' HD11 ' A' ' 45' ' ' ILE . 30.1 t -39.13 -33.04 0.11 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.374 179.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 12.9 m -78.88 -28.35 44.1 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.163 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 34' ' ' LEU . 3.0 tt0 -73.42 -60.63 2.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.877 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 1.091 HD23 HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -56.57 -49.77 73.88 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 121.05 0.453 . . . . 0.0 110.329 179.756 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 108.95 46.26 0.96 Allowed Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.721 -179.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 1.091 HD11 HD23 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -130.17 -160.38 1.03 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.113 0.482 . . . . 0.0 111.413 -179.322 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -118.69 -88.76 0.61 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.675 -0.693 . . . . 0.0 112.068 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.401 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 0.2 OUTLIER -141.04 -46.14 0.39 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.76 0.314 . . . . 0.0 111.1 -179.325 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.949 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -65.98 -12.89 58.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.165 179.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.534 ' NE2' ' H ' ' A' ' 44' ' ' GLN . 0.3 OUTLIER -101.14 -20.27 15.39 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.485 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.885 HG22 ' HE2' ' A' ' 49' ' ' PHE . 41.9 mm -57.58 -60.58 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.501 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -58.02 -16.79 13.9 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.704 178.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.949 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -77.37 -36.08 23.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -178.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.858 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.8 -31.69 46.07 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 118.653 -1.219 . . . . 0.0 111.777 -179.354 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.885 ' HE2' HG22 ' A' ' 45' ' ' ILE . 4.9 m-85 -65.54 -42.49 91.88 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.064 178.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.465 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 6.5 pt20 -61.18 -28.4 69.11 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.741 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -85.92 -29.89 23.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.949 178.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -29.71 67.85 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.595 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.08 -30.41 17.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.869 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.81 -27.25 65.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.232 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.543 ' O ' HG22 ' A' ' 56' ' ' ILE . 0.1 OUTLIER -56.73 -28.1 60.43 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.1 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.543 HG22 ' O ' ' A' ' 55' ' ' LYS . 7.5 tt 47.16 36.14 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.216 0 CA-C-O 121.417 0.627 . . . . 0.0 110.892 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -174.1 -41.4 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.891 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 43.94 35.39 1.12 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.451 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.3 t . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.895 179.985 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.219 0 N-CA-C 112.486 -0.246 . . . . 0.0 112.486 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -154.89 96.2 1.83 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.898 0.38 . . . . 0.0 110.859 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -169.26 57.36 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.831 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -177.33 66.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.757 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.07 137.69 19.3 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.799 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -79.95 -175.88 2.94 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.595 2.197 . . . . 0.0 112.354 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.1 ttt-85 -142.72 45.38 1.6 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.061 0.458 . . . . 0.0 110.918 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.1 m -167.19 -49.57 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.277 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.641 ' O ' ' CD1' ' A' ' 8' ' ' PHE . . . -49.72 -26.59 3.92 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.813 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.641 ' CD1' ' O ' ' A' ' 7' ' ' ALA . 2.6 m-30 145.92 118.25 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 O-C-N 124.132 0.895 . . . . 0.0 111.067 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.492 ' O ' ' CB ' ' A' ' 10' ' ' SER . 25.1 t -153.93 31.89 0.44 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.25 178.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.588 ' H ' HD21 ' A' ' 13' ' ' LEU . 5.1 t 90.39 -28.8 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.849 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -83.09 -37.37 23.91 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.503 -0.772 . . . . 0.0 111.354 -179.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.18 -18.48 46.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.2 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.604 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -95.91 -25.91 15.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.748 0.308 . . . . 0.0 110.522 179.553 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.59 -30.04 25.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.863 179.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -37.02 72.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.841 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.78 -40.86 94.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.088 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.606 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -60.14 -48.05 83.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.505 179.739 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.63 -31.95 63.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.332 179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -64.06 -46.24 85.21 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.219 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.606 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.9 OUTLIER -85.17 -23.71 28.24 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.1 -179.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -52.35 -25.6 10.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.954 0.407 . . . . 0.0 110.552 179.225 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -96.0 -10.84 27.55 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.3 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.83 ' HA ' HD22 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -128.67 39.29 3.83 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.851 0.358 . . . . 0.0 111.385 179.91 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.432 ' O ' HG23 ' A' ' 27' ' ' THR . 0.0 OUTLIER -124.91 -38.5 2.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.308 0.575 . . . . 0.0 111.0 -179.548 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.476 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 15.9 p90 -83.54 -40.7 18.81 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.0 -179.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.83 HD22 ' HA ' ' A' ' 23' ' ' ASN . 2.2 pt? -47.76 -28.22 2.4 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.357 0.598 . . . . 0.0 110.536 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.439 ' H ' HD23 ' A' ' 26' ' ' LEU . 1.2 p -58.2 -23.91 57.29 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.783 178.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -130.31 21.39 5.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.703 178.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.54 -51.24 1.38 Allowed 'General case' 0 C--O 1.231 0.087 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.94 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.515 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -131.26 4.29 4.36 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.855 -179.681 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 26' ' ' LEU . 2.9 ttt180 -58.61 -26.42 63.66 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.871 0.367 . . . . 0.0 110.667 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.94 -21.11 34.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.055 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.95 -37.95 15.97 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.635 -0.712 . . . . 0.0 109.52 179.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.837 HD22 HD21 ' A' ' 38' ' ' LEU . 0.5 OUTLIER -65.37 -49.27 69.95 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.672 178.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.79 ' HA ' HD11 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -47.91 -27.09 1.97 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.092 179.266 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.99 -11.9 27.66 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.601 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.403 ' N ' ' O ' ' A' ' 34' ' ' LEU . 9.6 tp10 -76.91 -62.51 1.62 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.638 0.256 . . . . 0.0 110.955 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.934 HD23 ' CD1' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -69.15 -47.63 64.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.187 0.518 . . . . 0.0 110.177 179.528 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 124.68 2.54 8.03 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.501 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.934 ' CD1' HD23 ' A' ' 38' ' ' LEU . 0.2 OUTLIER -102.15 -165.42 1.18 Allowed 'General case' 0 CA--C 1.527 0.093 0 CA-C-O 121.095 0.474 . . . . 0.0 111.396 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.545 ' O ' HG12 ' A' ' 45' ' ' ILE . 17.4 t30 -113.76 166.91 11.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.314 -179.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.56 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 91.4 mt-10 -53.07 -28.31 24.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.479 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.792 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -63.82 -48.92 74.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.982 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.545 ' H ' HE21 ' A' ' 44' ' ' GLN . 0.0 OUTLIER -87.11 -15.09 39.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.225 179.414 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.964 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 2.5 mm -59.94 -58.62 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.538 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 0.2 OUTLIER -57.32 -18.15 15.66 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.1 178.012 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.792 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -79.39 -48.39 21.14 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 -178.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.964 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 34.0 p-90 -63.91 -25.84 68.33 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 119.392 -0.923 . . . . 0.0 112.177 -177.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.661 ' HE2' HG22 ' A' ' 45' ' ' ILE . 27.5 m-85 -66.33 -53.1 40.17 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 177.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.423 ' CG ' ' O ' ' A' ' 47' ' ' ILE . 1.7 pt20 -53.03 -26.49 15.86 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.252 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -87.23 -30.32 21.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.024 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.59 -28.51 63.86 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.738 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.564 ' O ' HG22 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -89.55 -29.09 19.16 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.053 179.96 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.36 -15.74 59.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.48 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -100.45 25.48 7.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.078 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 53' ' ' ARG . 6.1 tt -140.5 42.1 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.146 0.498 . . . . 0.0 111.04 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.4 mtp180 -148.31 -46.76 0.15 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.848 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -69.6 0.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.897 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.4 t . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.276 -0.869 . . . . 0.0 110.861 180.0 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -162.65 31.81 0.1 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.799 0.333 . . . . 0.0 110.906 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -160.89 55.9 0.31 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.849 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.473 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 0.1 OUTLIER -144.65 48.06 1.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.827 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.551 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 4.7 ptt-85 47.79 112.34 0.0 OUTLIER Pre-proline 0 CA--C 1.534 0.33 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.091 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.453 ' HD2' ' HB3' ' A' ' 8' ' ' PHE . 6.6 Cg_exo -74.22 -160.09 0.1 OUTLIER 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.973 2.448 . . . . 0.0 112.209 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -128.47 44.77 2.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.285 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.416 HG23 ' N ' ' A' ' 7' ' ' ALA . 5.3 t -120.48 -45.63 2.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.497 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.733 ' HB1' ' HG3' ' A' ' 12' ' ' GLN . . . -167.45 -38.15 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.08 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.984 ' CD2' HD22 ' A' ' 13' ' ' LEU . 0.6 OUTLIER -72.61 59.39 0.45 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.809 179.53 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.53 ' O ' ' CB ' ' A' ' 10' ' ' SER . 1.1 p -107.53 37.18 2.48 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.09 0.471 . . . . 0.0 110.745 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 9' ' ' SER . 4.7 m 96.92 -30.82 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.603 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -74.68 -50.41 17.69 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.193 -179.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.733 ' HG3' ' HB1' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -66.86 -19.02 65.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.398 -179.823 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.984 HD22 ' CD2' ' A' ' 8' ' ' PHE . 0.1 OUTLIER -98.42 -26.08 14.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.836 0.351 . . . . 0.0 110.479 179.792 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.72 -29.13 25.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.642 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -83.56 -35.29 24.87 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.746 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.97 -38.75 83.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.911 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.562 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.8 OUTLIER -57.67 -45.1 85.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.257 179.576 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.432 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 10.5 ttp85 -74.36 -32.67 62.85 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.528 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.49 -32.84 73.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.288 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.562 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.4 OUTLIER -105.06 -15.37 15.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.719 0.295 . . . . 0.0 111.35 -179.847 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.432 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -47.83 -34.16 8.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.905 0.383 . . . . 0.0 110.862 179.646 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.451 ' O ' ' CD2' ' A' ' 26' ' ' LEU . 15.5 mt-10 -83.59 -16.37 45.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.872 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.519 ' HA ' ' CG ' ' A' ' 26' ' ' LEU . 1.7 m-80 -98.92 30.93 3.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.514 0.673 . . . . 0.0 109.784 179.411 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.6 -20.68 15.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.275 -179.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.514 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 12.4 p90 -116.26 -44.6 2.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.487 -178.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.521 ' HB2' ' HB3' ' A' ' 30' ' ' ARG . 0.5 OUTLIER -48.98 -27.11 2.91 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.304 0.574 . . . . 0.0 110.382 -179.811 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.419 HG23 ' H ' ' A' ' 27' ' ' THR . 0.5 OUTLIER -59.53 -24.0 63.32 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.839 178.907 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -130.93 0.29 4.25 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.996 179.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.85 -29.54 6.35 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.988 0.423 . . . . 0.0 110.997 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.521 ' HB3' ' HB2' ' A' ' 26' ' ' LEU . 6.6 ttm180 -115.89 -24.39 8.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.895 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.627 ' HG3' HG21 ' A' ' 45' ' ' ILE . 32.4 ttp180 -49.47 -31.57 10.25 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.188 0.518 . . . . 0.0 110.161 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -38.29 73.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.973 179.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.444 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.6 OUTLIER -78.02 -37.11 47.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.94 179.219 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.852 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 4.0 mt -67.41 -41.73 84.4 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.519 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.778 ' HA ' HD11 ' A' ' 45' ' ' ILE . 3.4 t -55.66 -26.92 47.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.649 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -112.05 3.13 17.17 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.101 179.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.574 ' HB3' HD23 ' A' ' 38' ' ' LEU . 4.4 tt0 -85.57 -48.03 9.31 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.024 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.968 HD12 HD21 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -96.34 -31.92 12.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.797 0.332 . . . . 0.0 110.479 179.645 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 104.31 46.28 1.35 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.546 -0.835 . . . . 0.0 113.315 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.968 HD21 HD12 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -127.25 -163.95 1.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.979 0.419 . . . . 0.0 111.331 179.227 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.432 ' O ' HG12 ' A' ' 45' ' ' ILE . 1.0 OUTLIER -97.96 148.64 23.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.017 -179.176 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -53.77 -40.45 66.27 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.099 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.661 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -71.96 -31.12 65.99 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 121.755 0.788 . . . . 0.0 109.247 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.517 ' HA ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -77.73 -14.82 59.49 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.177 -1.374 . . . . 0.0 110.273 -179.832 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.825 HD13 ' HE1' ' A' ' 48' ' ' TRP . 5.9 mm -63.29 -57.19 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.464 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -58.39 -16.53 15.14 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.917 177.795 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.661 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -79.39 -39.64 20.98 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.143 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -178.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.852 ' CZ2' HD22 ' A' ' 34' ' ' LEU . 27.1 p-90 -74.06 -27.54 60.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 118.732 -1.187 . . . . 0.0 112.319 -178.06 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.79 ' HE2' HG22 ' A' ' 45' ' ' ILE . 7.4 m-85 -68.48 -46.29 70.1 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.9 pt20 -60.54 -25.6 66.26 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.829 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -88.21 -31.37 19.12 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.985 178.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.53 -28.2 63.72 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.76 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.99 -39.78 14.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.929 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.423 ' HB1' HG22 ' A' ' 56' ' ' ILE . . . -72.65 -56.73 4.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.103 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.2 mttp 61.49 33.79 18.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.989 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.423 HG22 ' HB1' ' A' ' 54' ' ' ALA . 0.7 OUTLIER -140.39 42.77 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.187 0.518 . . . . 0.0 110.994 -179.948 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -122.05 -39.12 2.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.892 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.36 -31.02 63.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.994 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.201 -0.905 . . . . 0.0 110.938 179.921 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.452 -0.259 . . . . 0.0 112.452 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -122.02 177.47 5.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.812 0.339 . . . . 0.0 110.893 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 62.87 46.9 4.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.7 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.67 46.56 1.78 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.926 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.45 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 3.9 mtm-85 -106.6 130.55 22.74 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.661 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 37.1 Cg_exo -61.81 -162.49 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.397 2.064 . . . . 0.0 112.283 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.518 ' O ' ' HB ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -122.85 22.67 9.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.831 179.015 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.562 ' O ' ' HB2' ' A' ' 7' ' ' ALA . 11.0 t 176.14 -50.9 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.455 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.562 ' HB2' ' O ' ' A' ' 6' ' ' THR . . . 165.91 38.65 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.024 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.782 ' CG ' HD21 ' A' ' 13' ' ' LEU . 0.4 OUTLIER -145.89 94.33 2.47 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.783 -179.765 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.551 ' C ' ' H ' ' A' ' 11' ' ' GLU . 3.2 p -80.7 31.37 0.3 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -178.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.5 m 72.6 -26.79 0.18 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.859 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.551 ' H ' ' C ' ' A' ' 9' ' ' SER . 9.8 mt-10 -72.54 -49.26 33.91 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.564 -179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.471 ' HB3' ' CE1' ' A' ' 8' ' ' PHE . 0.9 OUTLIER -53.65 -29.05 36.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.32 179.397 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.782 HD21 ' CG ' ' A' ' 8' ' ' PHE . 0.6 OUTLIER -75.6 -33.71 60.56 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.073 179.386 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.88 -32.83 65.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.017 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.1 ttp180 -86.8 -29.19 22.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.438 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -79.42 -3.74 47.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.115 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.3 OUTLIER -96.75 -55.51 2.87 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.318 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.427 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 43.2 ttp85 -64.54 -30.56 71.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.898 178.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.404 ' O ' ' ND2' ' A' ' 23' ' ' ASN . 0.3 OUTLIER -54.58 -27.43 38.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.779 179.799 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.514 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 4.1 p90 -118.72 -30.52 5.09 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.399 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.427 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 0.7 OUTLIER -48.76 -28.17 3.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.785 0.326 . . . . 0.0 110.877 179.865 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.974 ' C ' HD21 ' A' ' 26' ' ' LEU . 7.4 tm-20 -108.17 22.05 16.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.951 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.66 ' HA ' HD11 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -163.73 31.38 0.08 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.27 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.514 ' HB3' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -126.75 -44.1 1.68 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.117 0.484 . . . . 0.0 110.905 -179.358 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.984 ' CE1' HD23 ' A' ' 26' ' ' LEU . 15.4 p90 -93.35 -45.94 7.58 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.096 -179.112 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.984 HD23 ' CE1' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -51.16 -27.28 8.29 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.325 0.583 . . . . 0.0 110.124 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.4 p -59.52 -21.87 60.82 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.94 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -131.37 1.32 4.14 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.712 178.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -115.91 -31.59 5.71 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 120.948 0.404 . . . . 0.0 111.009 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.441 ' HB3' ' HB2' ' A' ' 26' ' ' LEU . 4.8 ttt85 -117.57 -23.62 7.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.275 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.592 ' CG ' HG21 ' A' ' 45' ' ' ILE . 34.7 ttp180 -50.74 -30.06 12.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.045 0.45 . . . . 0.0 110.615 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.46 -31.1 62.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.338 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.471 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.3 OUTLIER -75.86 -37.53 58.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.408 179.615 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.681 ' HB3' ' CH2' ' A' ' 48' ' ' TRP . 6.9 mt -68.29 -62.7 1.28 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 39.5 t -43.06 -30.17 0.41 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.196 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.6 t -79.18 -38.72 35.18 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.265 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.64 -15.81 31.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.074 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.709 ' HG ' ' CZ2' ' A' ' 48' ' ' TRP . 2.7 mm? -88.98 -27.58 20.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.631 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 58.91 65.52 3.43 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.719 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.811 HD22 ' CB ' ' A' ' 44' ' ' GLN . 0.5 OUTLIER -154.66 -164.78 1.9 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.993 0.425 . . . . 0.0 111.577 -178.889 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.449 ' O ' ' NE2' ' A' ' 44' ' ' GLN . 35.5 t30 -118.97 172.07 7.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.321 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.416 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 5.5 mt-10 -53.39 -23.53 9.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.678 0.275 . . . . 0.0 111.469 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.905 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -70.1 -9.45 55.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.933 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.811 ' CB ' HD22 ' A' ' 40' ' ' LEU . 1.1 mp0 -117.32 -26.65 6.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.053 0.454 . . . . 0.0 109.78 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.997 HG22 ' HE2' ' A' ' 49' ' ' PHE . 12.9 mm -57.41 -59.26 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.426 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -55.9 -25.54 43.33 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.129 179.281 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.905 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -62.89 -32.51 56.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.748 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.724 ' CZ2' HD13 ' A' ' 45' ' ' ILE . 1.1 m0 -70.89 -63.93 1.0 Allowed 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.523 0.678 . . . . 0.0 110.229 179.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.997 ' HE2' HG22 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -61.97 -24.22 66.88 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.82 -179.244 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.773 ' O ' ' HB2' ' A' ' 54' ' ' ALA . 7.3 mt-30 -56.88 -29.15 62.68 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -88.32 -27.78 21.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.211 179.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.91 -27.27 49.48 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.794 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.62 31.89 6.42 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.909 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.773 ' HB2' ' O ' ' A' ' 50' ' ' GLN . . . -103.79 -60.59 1.55 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.065 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.407 ' O ' ' HB ' ' A' ' 56' ' ' ILE . 18.2 mtmm -136.29 -46.92 0.63 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.951 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.407 ' HB ' ' O ' ' A' ' 55' ' ' LYS . 3.8 mt 80.17 69.12 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 121.202 0.525 . . . . 0.0 110.814 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.21 -42.31 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.934 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? 60.58 98.66 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.748 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.286 -0.864 . . . . 0.0 110.85 -179.911 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 112.596 -0.202 . . . . 0.0 112.596 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 18.9 p30 -154.75 167.69 29.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 0.0 110.875 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -158.3 51.48 0.42 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.938 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.09 66.59 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.1 ptt-85 -79.49 139.45 55.26 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.797 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -82.12 -167.18 0.45 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.618 2.212 . . . . 0.0 112.592 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.61 45.12 2.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.43 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.478 HG23 ' N ' ' A' ' 7' ' ' ALA . 7.2 t -125.03 -48.55 1.74 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.442 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.478 ' N ' HG23 ' A' ' 6' ' ' THR . . . -138.87 25.64 2.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.381 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.519 ' CE1' ' HB3' ' A' ' 13' ' ' LEU . 1.7 m-85 -145.02 72.81 1.34 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.805 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.496 ' O ' ' CB ' ' A' ' 10' ' ' SER . 0.6 OUTLIER -103.33 32.75 3.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.165 0.507 . . . . 0.0 111.208 -179.795 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.57 ' H ' HD21 ' A' ' 13' ' ' LEU . 5.5 t 89.73 -27.67 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.048 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -89.72 -9.66 48.61 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.868 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -103.91 -17.63 14.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.634 0.254 . . . . 0.0 111.383 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.57 HD21 ' H ' ' A' ' 10' ' ' SER . 0.6 OUTLIER -106.08 -22.99 12.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.006 0.432 . . . . 0.0 110.286 179.24 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.54 -17.74 57.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.665 178.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.401 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 4.5 mtt180 -61.53 -30.11 70.43 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.109 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -76.44 -1.43 27.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.835 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.481 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.2 OUTLIER -126.59 -15.58 5.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.721 -0.218 . . . . 0.0 111.401 -179.75 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.4 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 2.7 ttp180 -110.12 -37.11 5.66 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.707 0.289 . . . . 0.0 111.201 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 5.2 mm-40 -62.66 -35.14 78.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.082 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.703 ' HA ' ' OD1' ' A' ' 23' ' ' ASN . 0.5 OUTLIER -91.86 -23.12 19.76 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.904 -0.318 . . . . 0.0 110.944 179.836 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.411 ' ND2' ' O ' ' A' ' 17' ' ' LYS . 0.3 OUTLIER -55.3 -24.96 31.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.005 0.431 . . . . 0.0 110.155 179.155 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -91.6 -2.29 57.17 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.092 179.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.798 ' HB2' HD11 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -132.6 38.63 3.41 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-O 121.568 0.699 . . . . 0.0 110.677 179.4 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.482 ' O ' HG23 ' A' ' 27' ' ' THR . 0.1 OUTLIER -93.66 -48.69 6.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.175 179.722 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.511 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 10.8 p90 -70.69 -43.84 68.21 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.682 -1.144 . . . . 0.0 111.696 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.798 HD11 ' HB2' ' A' ' 23' ' ' ASN . 1.2 pp -53.87 -20.64 6.23 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.201 0.524 . . . . 0.0 110.754 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.494 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 3.3 p -65.82 -19.06 65.75 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.037 178.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -135.08 16.29 3.5 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.726 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.409 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -118.5 -51.41 2.4 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.639 -179.761 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.531 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -132.81 7.88 4.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.467 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.494 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 47.3 ttt180 -80.06 -2.37 44.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.903 0.382 . . . . 0.0 110.867 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -97.59 -28.91 13.73 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -69.78 -35.33 74.8 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.56 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.051 HD23 HD21 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -66.31 -63.87 0.98 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.446 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.511 ' CB ' HD11 ' A' ' 45' ' ' ILE . 17.8 t -40.3 -31.79 0.15 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.943 -1.026 . . . . 0.0 111.539 179.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.47 -36.98 21.91 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.946 -179.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -85.09 -19.37 31.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.894 0.378 . . . . 0.0 111.07 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 1.051 HD21 HD23 ' A' ' 34' ' ' LEU . 4.4 mm? -78.3 -49.98 12.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.779 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 104.48 21.22 9.45 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.718 -0.673 . . . . 0.0 111.818 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.77 HD13 HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -109.02 -160.54 0.72 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.163 0.506 . . . . 0.0 111.101 -179.847 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -120.84 -101.04 0.42 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.486 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -129.63 -42.62 1.29 Allowed 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.722 0.296 . . . . 0.0 111.516 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.918 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -73.36 -2.78 23.58 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.763 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.506 ' NE2' ' N ' ' A' ' 44' ' ' GLN . 0.9 OUTLIER -106.02 -23.29 12.68 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.407 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.858 HG22 ' HE2' ' A' ' 49' ' ' PHE . 38.5 mm -56.8 -61.21 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.869 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -15.37 11.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.796 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.918 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.4 mp -79.11 -36.19 18.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -178.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.927 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.68 -29.65 45.74 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 118.463 -1.295 . . . . 0.0 111.902 -179.155 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.858 ' HE2' HG22 ' A' ' 45' ' ' ILE . 4.5 m-85 -69.41 -42.19 75.4 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 119.683 -0.807 . . . . 0.0 109.187 178.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.467 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 5.8 pt20 -60.81 -28.77 69.03 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.968 179.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -89.7 -28.35 19.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.056 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 33.5 tttt -78.74 -23.73 45.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.873 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -97.7 23.76 7.51 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.03 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -86.85 -43.55 12.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.118 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.419 ' O ' ' HB ' ' A' ' 56' ' ' ILE . 3.0 mptm? 62.3 33.34 16.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.873 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.419 ' HB ' ' O ' ' A' ' 55' ' ' LYS . 3.8 mt 80.81 69.32 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.873 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -117.19 -38.72 3.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.809 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -60.44 -69.71 0.21 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.822 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.3 p . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.955 -179.918 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.201 0 N-CA-C 112.488 -0.245 . . . . 0.0 112.488 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 2.3 t70 60.33 35.84 20.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.818 0.342 . . . . 0.0 110.919 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -151.95 49.95 0.79 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.912 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -160.12 56.75 0.36 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.878 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.9 mmm180 61.56 156.2 0.11 Allowed Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.73 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.21 -167.16 0.12 Allowed 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.425 2.084 . . . . 0.0 112.233 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.9 ptp180 -164.92 61.46 0.13 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.031 0.443 . . . . 0.0 110.865 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.8 m -165.4 -48.61 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.225 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.627 ' O ' ' CD1' ' A' ' 8' ' ' PHE . . . -50.87 -26.11 5.4 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.81 179.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.627 ' CD1' ' O ' ' A' ' 7' ' ' ALA . 2.5 m-30 144.95 118.45 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.377 0 O-C-N 124.201 0.938 . . . . 0.0 110.99 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.498 ' O ' ' CB ' ' A' ' 10' ' ' SER . 29.5 t -158.26 32.2 0.24 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.076 0.465 . . . . 0.0 111.394 178.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.56 ' H ' HD21 ' A' ' 13' ' ' LEU . 3.1 m 90.68 -29.34 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.924 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -81.64 -37.94 26.74 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.584 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.67 -19.73 41.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.321 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.599 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -95.53 -26.65 15.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.796 0.332 . . . . 0.0 110.438 179.541 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.24 -29.48 31.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.936 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -40.72 97.5 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.018 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.31 -43.73 96.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.842 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.609 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 26.6 mtmt -63.02 -52.12 64.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.168 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 48.5 ttp85 -65.59 -31.67 72.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.547 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -65.6 -46.36 79.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.077 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.609 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.8 OUTLIER -88.22 -24.68 23.21 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.232 -179.875 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -48.45 -40.43 26.22 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.895 0.379 . . . . 0.0 110.712 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -92.21 -16.94 25.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.826 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.529 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER -103.02 32.66 3.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.311 0.577 . . . . 0.0 109.855 179.772 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.66 -40.74 2.31 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.625 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.428 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 7.9 p90 -89.91 -36.71 14.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.292 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.529 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -54.05 -11.48 0.46 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.092 0.473 . . . . 0.0 111.183 -179.889 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.469 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -81.82 -20.67 38.57 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.779 179.654 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -132.97 11.38 4.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.107 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.04 -42.11 2.04 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.809 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.408 ' HD3' ' CB ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -112.44 -14.82 13.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.362 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 ttm180 -51.78 -30.84 24.52 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.069 0.461 . . . . 0.0 110.399 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.3 -48.05 18.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.17 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.3 -33.52 73.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.231 0.538 . . . . 0.0 109.817 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.803 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 5.1 mt -67.88 -57.27 6.52 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.515 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.46 -23.72 10.91 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.244 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.97 -27.67 23.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.387 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -111.08 29.49 7.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.785 0.326 . . . . 0.0 111.286 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.506 ' HG ' HD11 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -132.7 -56.33 0.94 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.239 0.542 . . . . 0.0 110.673 179.75 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 121.11 3.28 10.75 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.494 -0.776 . . . . 0.0 112.009 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.537 ' HB3' ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -94.22 -158.66 0.64 Allowed 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.329 0.585 . . . . 0.0 111.234 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.414 ' HB3' HE22 ' A' ' 44' ' ' GLN . 33.6 t30 -119.06 -59.82 1.81 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.494 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.403 ' O ' ' HB ' ' A' ' 45' ' ' ILE . 1.4 mt-10 174.72 -42.2 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.925 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -72.52 -12.04 60.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.288 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.59 ' NE2' ' H ' ' A' ' 44' ' ' GLN . 1.4 mp0 -101.28 -15.78 17.17 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.931 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 2.7 mm -63.02 -58.74 6.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.765 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.457 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.465 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 2.6 mtmt -56.97 -19.09 16.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.047 178.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.925 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -78.12 -47.25 25.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 113.75 1.019 . . . . 0.0 113.75 -178.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.931 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 40.9 p-90 -65.53 -25.06 67.28 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 119.171 -1.012 . . . . 0.0 112.176 -177.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.683 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 23.3 m-85 -69.14 -53.96 17.4 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 176.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.559 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.4 pt20 -57.04 -28.52 62.59 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.9 179.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -84.66 -29.66 25.5 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.883 178.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -67.94 -29.7 68.83 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.558 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.03 30.49 6.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.83 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -106.1 -61.33 1.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.177 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.549 ' O ' HG22 ' A' ' 56' ' ' ILE . 9.4 mmpt? -76.32 -60.94 2.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.805 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.549 HG22 ' O ' ' A' ' 55' ' ' LYS . 0.6 OUTLIER 46.92 36.2 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 CA-C-O 121.484 0.659 . . . . 0.0 110.849 -179.717 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -148.2 -66.57 0.24 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.939 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 58.07 30.86 19.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.995 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.873 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.554 -0.219 . . . . 0.0 112.554 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.2 -28.2 69.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.742 0.305 . . . . 0.0 110.919 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -137.26 46.78 2.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.894 0.378 . . . . 0.0 110.839 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -173.7 64.9 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.833 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.07 136.15 62.0 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.8 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.472 ' HB3' ' CB ' ' A' ' 9' ' ' SER . 84.0 Cg_endo -86.51 -165.36 0.25 Allowed 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.737 2.291 . . . . 0.0 112.366 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.0 ptt180 -117.79 37.96 3.78 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-O 121.262 0.553 . . . . 0.0 110.771 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.609 ' O ' ' HB2' ' A' ' 7' ' ' ALA . 23.7 m -147.76 -62.6 0.27 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.257 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.609 ' HB2' ' O ' ' A' ' 6' ' ' THR . . . 158.08 -19.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.364 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.739 ' CG ' HD21 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -141.57 96.47 2.99 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.83 179.315 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.472 ' CB ' ' HB3' ' A' ' 4' ' ' PRO . 12.7 p -69.75 42.71 0.05 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.292 -178.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.475 ' HA ' HD12 ' A' ' 13' ' ' LEU . 5.7 t 79.8 -28.29 0.14 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.324 0.583 . . . . 0.0 110.3 -179.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.455 ' H ' ' C ' ' A' ' 9' ' ' SER . 3.6 tp10 -65.22 -45.75 83.44 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.672 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.491 ' CB ' ' HB3' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -68.41 -31.77 71.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.882 178.925 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.739 HD21 ' CG ' ' A' ' 8' ' ' PHE . 12.6 mt -67.84 -33.61 75.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.629 178.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.41 -33.1 60.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.926 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.43 -42.52 96.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.622 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.05 -37.34 86.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.795 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.616 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 5.1 mtmt -59.21 -46.09 89.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.241 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.4 ttp85 -70.95 -33.81 70.85 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.461 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -66.81 -49.68 65.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.887 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.619 ' HA ' ' OD1' ' A' ' 23' ' ' ASN . 0.4 OUTLIER -84.34 -15.92 44.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.013 179.876 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -48.14 -29.82 4.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.127 0.489 . . . . 0.0 109.724 178.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.436 ' O ' ' CD2' ' A' ' 26' ' ' LEU . 20.6 mt-10 -84.57 -32.33 23.86 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.313 179.05 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.619 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.8 OUTLIER -105.72 36.25 2.6 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 121.887 0.851 . . . . 0.0 109.632 178.796 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.438 ' HB2' ' CE1' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -101.95 -27.91 12.69 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.288 -1.324 . . . . 0.0 110.868 -179.982 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.513 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.0 p90 -107.45 -44.81 4.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.85 -178.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.549 HD21 ' HA ' ' A' ' 23' ' ' ASN . 1.1 pp -50.61 -26.21 5.09 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.237 0.541 . . . . 0.0 110.601 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.462 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 1.2 p -65.39 -19.5 65.97 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.331 -0.849 . . . . 0.0 109.768 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -133.73 7.44 3.79 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.248 178.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.428 ' N ' ' O ' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -110.81 -50.37 2.96 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.394 179.99 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.412 ' HG2' ' HB2' ' A' ' 26' ' ' LEU . 7.4 ptm180 -117.74 -9.02 10.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.207 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.492 ' HG3' HG21 ' A' ' 45' ' ' ILE . 4.5 ttp85 -54.08 -27.91 35.75 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.968 0.413 . . . . 0.0 110.589 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -82.65 -27.63 31.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.628 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.52 -40.1 43.84 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.921 179.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.867 ' O ' HD22 ' A' ' 38' ' ' LEU . 0.2 OUTLIER -64.25 -59.5 4.33 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.574 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.595 ' CB ' HD11 ' A' ' 45' ' ' ILE . 32.6 t -38.75 -32.82 0.09 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.353 179.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.7 m -80.49 -27.1 37.86 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.448 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.584 ' N ' ' O ' ' A' ' 34' ' ' LEU . 8.9 tm-20 -73.74 -61.26 1.9 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.884 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 1.105 HD23 HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -53.88 -53.25 55.15 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.105 0.478 . . . . 0.0 110.396 179.783 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.55 36.09 1.64 Allowed Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.595 -179.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 1.105 HD11 HD23 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -117.57 -160.53 0.78 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.144 0.497 . . . . 0.0 111.398 -179.442 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -118.62 -101.32 0.43 Allowed 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.645 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -128.14 -44.22 1.45 Allowed 'General case' 0 C--O 1.231 0.098 0 CA-C-O 120.689 0.281 . . . . 0.0 111.636 -179.237 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.925 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -72.56 -2.79 21.21 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.788 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.5 ' NE2' ' H ' ' A' ' 44' ' ' GLN . 0.8 OUTLIER -106.57 -21.99 12.9 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.347 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.899 HG22 ' HE2' ' A' ' 49' ' ' PHE . 42.1 mm -58.03 -61.57 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 178.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.41 ' HG3' HD12 ' A' ' 47' ' ' ILE . 14.6 ptpt -57.68 -16.45 10.78 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.667 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.925 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -76.3 -39.96 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -178.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.864 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -74.23 -41.44 61.33 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 118.797 -1.161 . . . . 0.0 111.846 -179.111 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.899 ' HE2' HG22 ' A' ' 45' ' ' ILE . 2.1 m-85 -57.57 -34.3 69.06 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 119.425 -0.91 . . . . 0.0 108.968 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -50.79 -28.22 8.85 Favored 'General case' 0 C--O 1.231 0.081 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.948 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -87.44 -30.99 20.28 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.264 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.617 ' O ' HD11 ' A' ' 56' ' ' ILE . 0.1 OUTLIER -76.43 -27.81 56.38 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.712 179.656 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.1 mtp85 -108.38 29.96 6.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.841 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -93.89 -64.54 1.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.08 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.408 ' O ' ' HB ' ' A' ' 56' ' ' ILE . 4.7 mttm -142.68 -68.26 0.36 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.885 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.617 HD11 ' O ' ' A' ' 52' ' ' LYS . 3.2 mt 79.83 69.13 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 121.186 0.517 . . . . 0.0 110.77 -179.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -177.05 -47.12 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.637 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.08 69.4 0.73 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.896 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.952 179.943 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.097 0 N-CA-C 112.594 -0.202 . . . . 0.0 112.594 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -136.49 160.93 37.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.815 0.34 . . . . 0.0 110.916 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -143.95 47.39 1.43 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.77 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -156.48 50.95 0.51 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.843 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.469 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 17.8 mtt85 -134.98 116.59 12.42 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.04 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 6.3 Cg_exo -79.43 -164.09 0.26 Allowed 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.023 2.482 . . . . 0.0 112.186 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -157.02 57.59 0.52 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.554 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.516 HG23 ' N ' ' A' ' 7' ' ' ALA . 9.8 t -144.88 -50.88 0.27 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.993 0.425 . . . . 0.0 111.254 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.516 ' N ' HG23 ' A' ' 6' ' ' THR . . . -100.54 -56.36 2.36 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.744 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.791 ' CG ' HD21 ' A' ' 13' ' ' LEU . 0.0 OUTLIER 170.44 113.48 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.26 179.709 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.498 ' O ' ' CB ' ' A' ' 10' ' ' SER . 1.4 p -88.97 35.88 0.8 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -179.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.498 ' CB ' ' O ' ' A' ' 9' ' ' SER . 2.9 m 90.51 -30.98 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.529 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -64.1 -35.45 80.78 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.74 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.457 ' CB ' ' HB3' ' A' ' 8' ' ' PHE . 1.9 mt-30 -81.19 -28.8 34.79 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.935 179.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.791 HD21 ' CG ' ' A' ' 8' ' ' PHE . 10.1 mt -72.94 -37.59 67.11 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.88 179.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.94 -36.42 72.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.785 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -74.47 -47.86 30.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.663 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.26 -36.18 79.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.793 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.548 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 9.5 ttmt -59.91 -49.35 78.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.201 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.4 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 0.0 OUTLIER -70.48 -32.36 69.86 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.44 179.47 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -64.95 -42.69 94.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.268 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.548 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.8 OUTLIER -94.67 -22.43 18.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.513 -179.715 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.4 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 0.4 OUTLIER -42.73 -32.4 0.59 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.782 0.325 . . . . 0.0 111.44 -179.884 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.427 ' O ' HD13 ' A' ' 26' ' ' LEU . 18.8 mt-10 -108.76 -14.65 14.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.342 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.546 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 2.9 m120 -104.98 32.96 3.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.193 0.521 . . . . 0.0 110.231 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.424 ' HB3' ' O ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -125.23 -44.55 1.88 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.365 -178.759 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.441 ' H ' ' HD1' ' A' ' 25' ' ' TYR . 3.5 p90 -88.19 -34.17 17.9 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.135 -178.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.546 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER -55.26 -8.94 0.36 Allowed 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.233 -179.861 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.462 HG23 HD23 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -91.52 11.34 24.4 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.179 179.839 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.72 -42.35 0.07 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.212 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.84 -55.43 4.99 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.452 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.531 ' HD3' HD12 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -89.07 -20.63 24.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.725 179.6 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.883 ' HD2' HG21 ' A' ' 45' ' ' ILE . 0.6 OUTLIER -59.44 -43.64 93.09 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.645 179.838 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -64.69 -29.01 70.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.944 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.448 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.21 -40.02 38.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.777 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.681 HD13 ' CZ3' ' A' ' 48' ' ' TRP . 10.8 mt -70.37 -59.04 3.1 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.836 ' OG ' HD11 ' A' ' 45' ' ' ILE . 2.2 t -39.51 -33.15 0.15 Allowed 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.38 178.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.82 -38.23 46.8 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.517 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 34' ' ' LEU . 5.4 mt-10 -88.88 -18.8 26.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.51 -179.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.741 ' HB3' HD22 ' A' ' 40' ' ' LEU . 4.2 mm? -89.11 -1.06 57.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.63 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 48.93 69.3 1.03 Allowed Glycine 0 C--N 1.335 0.487 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.876 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.741 HD22 ' HB3' ' A' ' 38' ' ' LEU . 1.8 pt? -154.22 -150.85 0.34 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.357 0.598 . . . . 0.0 111.676 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -136.1 -89.71 0.3 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.692 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.485 ' HA ' HG13 ' A' ' 45' ' ' ILE . 2.5 tt0 -137.08 -46.9 0.58 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.798 0.332 . . . . 0.0 111.541 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.446 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -65.23 -19.61 66.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.685 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.788 ' HA ' HD13 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -95.36 -18.57 20.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.984 0.421 . . . . 0.0 110.105 179.775 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.926 HD13 ' CZ2' ' A' ' 48' ' ' TRP . 7.7 mm -54.71 -47.47 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.455 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -68.39 -10.59 56.14 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.789 178.172 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.788 HD13 ' HA ' ' A' ' 44' ' ' GLN . 1.1 mp -73.57 -32.34 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.381 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.926 ' CZ2' HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -71.44 -54.45 10.61 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.557 179.513 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.856 ' HE2' HG22 ' A' ' 45' ' ' ILE . 1.5 m-85 -64.09 -39.12 93.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.667 -178.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.46 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 3.6 pt20 -58.95 -24.93 63.07 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.316 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -90.66 -30.12 17.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.471 179.308 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -81.71 -24.6 36.07 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.901 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 4.7 tpt85 -79.37 -2.59 42.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.411 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -99.23 24.44 7.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.726 0.298 . . . . 0.0 111.151 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.66 36.09 0.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.962 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.41 HG23 ' O ' ' A' ' 56' ' ' ILE . 0.7 OUTLIER -130.32 42.41 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.054 0.454 . . . . 0.0 110.947 -179.97 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 -165.52 -54.57 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.902 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.95 90.08 0.06 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.893 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.898 179.983 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 N-CA-C 112.538 -0.225 . . . . 0.0 112.538 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -134.24 113.22 11.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.848 0.356 . . . . 0.0 110.828 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 64.05 47.64 3.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.775 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.53 46.82 1.2 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.888 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.5 mtp85 -80.61 132.2 58.9 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.651 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.436 ' HB3' ' CA ' ' A' ' 9' ' ' SER . 88.1 Cg_endo -89.43 -169.23 0.36 Allowed 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 122.771 2.314 . . . . 0.0 112.643 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -114.02 35.61 4.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.265 0.555 . . . . 0.0 110.732 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.512 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.1 OUTLIER -163.63 -74.73 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.334 179.58 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.512 ' H ' HG23 ' A' ' 6' ' ' THR . . . 179.3 30.85 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.069 179.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.857 ' CD1' HD13 ' A' ' 13' ' ' LEU . 0.4 OUTLIER 173.37 116.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.197 179.781 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.461 ' O ' ' CB ' ' A' ' 10' ' ' SER . 1.3 p -80.38 38.07 0.41 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.217 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.499 ' HA ' ' CD2' ' A' ' 13' ' ' LEU . 4.9 t 83.72 -21.97 0.25 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.889 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -102.7 11.82 37.15 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.273 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.507 ' CG ' ' HB3' ' A' ' 8' ' ' PHE . 0.4 OUTLIER -122.86 -21.42 5.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.687 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.857 HD13 ' CD1' ' A' ' 8' ' ' PHE . 0.5 OUTLIER -105.54 -10.61 16.77 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.021 0.439 . . . . 0.0 110.699 178.947 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.586 ' N ' HD23 ' A' ' 13' ' ' LEU . . . -77.92 -26.31 48.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.806 179.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.4 mtm180 -62.35 -36.88 83.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.717 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.63 -20.87 51.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.922 179.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.643 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -105.23 -47.25 4.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.049 179.533 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.432 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 12.3 ttm180 -59.64 -30.28 68.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.542 179.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.5 -48.46 77.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.779 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.643 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.9 p90 -86.18 -23.89 26.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.861 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.432 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 0.9 OUTLIER -54.28 -25.46 23.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.984 0.421 . . . . 0.0 109.962 178.903 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.651 ' C ' HD21 ' A' ' 26' ' ' LEU . 30.2 mt-10 -97.04 16.33 19.91 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.757 179.207 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.567 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -159.86 37.49 0.18 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.463 179.649 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -133.69 -32.72 1.11 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.664 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.503 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 16.7 p90 -105.09 -45.38 4.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.255 -0.429 . . . . 0.0 112.151 -178.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.651 HD21 ' C ' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -46.34 -35.23 5.2 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.656 0.741 . . . . 0.0 109.939 -179.696 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.449 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -51.52 -25.78 7.29 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.11 178.629 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -136.05 24.61 3.3 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.326 179.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.22 -52.03 0.96 Allowed 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.992 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.503 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -133.06 18.24 4.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.342 179.963 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 26' ' ' LEU . 44.0 ttp85 -67.38 -41.67 84.64 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.188 0.518 . . . . 0.0 109.8 179.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -43.0 91.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.226 179.374 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.53 -32.51 68.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.181 0.515 . . . . 0.0 109.912 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.8 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 5.8 mt -67.39 -57.85 5.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.338 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.4 t -51.25 -25.88 6.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.168 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.0 m -91.46 -20.34 21.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.416 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -114.34 27.77 9.24 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.812 0.339 . . . . 0.0 111.024 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.49 ' HG ' HD11 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -134.27 -59.57 0.82 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.122 0.487 . . . . 0.0 110.633 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 128.22 -6.96 6.76 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.754 -179.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.49 HD11 ' HG ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -91.27 -158.66 0.57 Allowed 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.288 0.566 . . . . 0.0 111.065 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.401 ' H ' ' NE2' ' A' ' 44' ' ' GLN . 0.9 OUTLIER -118.93 -71.67 0.73 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.262 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.405 ' HA ' HG13 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -169.68 -44.31 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.971 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -64.41 -18.58 64.84 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.999 178.447 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.444 ' HB2' ' HB3' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -98.82 -17.71 18.31 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.817 178.916 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.933 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 3.5 mm -62.22 -59.29 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.567 178.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.501 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 6.6 pttt -56.68 -18.74 13.32 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.22 178.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.971 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -79.09 -48.84 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 -178.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.933 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 44.1 p-90 -64.39 -25.38 67.99 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 119.373 -0.931 . . . . 0.0 112.323 -177.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.703 ' CE1' ' CH2' ' A' ' 48' ' ' TRP . 27.0 m-85 -66.94 -52.8 38.59 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 177.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -56.23 -27.3 54.44 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.997 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -85.04 -31.25 23.53 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.842 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.07 -30.39 70.9 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.635 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -76.38 -30.01 57.38 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.83 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -101.42 25.78 7.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.119 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -123.18 29.86 6.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.891 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.3 tt -173.1 42.57 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.128 0.49 . . . . 0.0 110.903 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 34.0 ttt-85 -132.16 -46.14 0.92 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.861 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.19 -36.61 78.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.814 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.819 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 112.471 -0.251 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -111.03 -25.53 9.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.718 0.294 . . . . 0.0 111.142 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 65.83 48.24 1.9 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.896 0.379 . . . . 0.0 110.851 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.457 ' O ' ' CG ' ' A' ' 3' ' ' ARG . 1.5 mtpp -162.99 60.76 0.19 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.476 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.457 ' CG ' ' O ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER 58.18 138.24 0.03 OUTLIER Pre-proline 0 CA--C 1.532 0.263 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.399 -179.704 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -87.5 -166.83 0.3 Allowed 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.678 2.252 . . . . 0.0 112.632 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.4 ' HA ' ' CB ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -145.13 52.58 1.2 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.207 179.8 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.698 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -137.01 -77.4 0.41 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.004 -179.399 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.698 ' H ' HG23 ' A' ' 6' ' ' THR . . . -64.4 -33.58 76.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.624 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.867 ' CD2' HD22 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -177.41 107.72 0.06 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.138 0.494 . . . . 0.0 111.671 179.718 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.538 ' O ' ' CB ' ' A' ' 10' ' ' SER . 0.2 OUTLIER -101.31 40.3 1.31 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.335 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.841 ' H ' HD21 ' A' ' 13' ' ' LEU . 4.7 m 96.64 -30.14 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.008 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -77.02 -18.95 57.8 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.761 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.516 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 0.3 OUTLIER -98.16 1.4 47.43 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.883 0.373 . . . . 0.0 111.413 179.886 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.892 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -119.79 -29.93 4.89 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.292 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.74 -26.46 54.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.063 178.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.41 -27.71 12.65 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.819 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.516 ' HB3' ' O ' ' A' ' 12' ' ' GLN . . . -86.35 -10.21 54.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.589 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.59 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 31.3 ttmt -110.59 -35.41 6.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.988 0.423 . . . . 0.0 110.185 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.461 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 0.0 OUTLIER -75.11 -31.7 61.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.63 179.538 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.23 -43.22 99.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.112 -179.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.59 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.4 p90 -91.85 -22.5 20.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.203 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.461 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 1.3 m-80 -53.08 -29.22 29.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.064 0.459 . . . . 0.0 109.913 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -86.84 -13.28 45.42 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.721 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.826 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -127.81 41.16 3.56 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.604 0.716 . . . . 0.0 110.361 179.181 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.411 ' HG3' ' N ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -99.5 -43.25 6.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.422 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.52 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 12.4 p90 -79.75 -44.25 21.07 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.656 -1.157 . . . . 0.0 111.79 -179.042 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.826 HD21 ' HA ' ' A' ' 23' ' ' ASN . 0.5 OUTLIER -50.05 -27.62 5.86 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.342 0.592 . . . . 0.0 110.319 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.475 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 2.3 p -61.37 -20.24 62.79 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.725 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -136.37 12.35 3.26 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.521 179.05 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.84 -29.97 4.21 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.042 -179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.451 ' HG3' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -146.64 20.25 1.32 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.784 179.886 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.475 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 2.3 ttt180 -88.57 -44.0 10.97 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 121.044 0.449 . . . . 0.0 109.813 179.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -59.75 -28.85 67.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.817 -0.628 . . . . 0.0 109.799 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.511 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -67.73 -34.87 77.69 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.271 179.421 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.006 HD23 HD21 ' A' ' 38' ' ' LEU . 0.9 OUTLIER -71.97 -61.41 1.8 Allowed 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.431 179.295 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.48 ' HA ' HD12 ' A' ' 40' ' ' LEU . 10.7 t -44.72 -29.5 0.78 Allowed 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.878 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.52 -26.43 18.78 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.179 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 34' ' ' LEU . 4.3 tt0 -106.04 20.11 19.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.786 0.327 . . . . 0.0 110.88 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 1.006 HD21 HD23 ' A' ' 34' ' ' LEU . 2.7 mm? -118.72 -43.43 2.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.39 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 99.31 34.87 4.92 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.669 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.822 HD13 HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -123.93 -159.6 0.87 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.23 0.538 . . . . 0.0 111.646 -179.378 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.51 -84.82 0.65 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.794 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -147.07 -46.9 0.18 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.859 0.361 . . . . 0.0 110.681 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.987 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -67.6 -11.68 58.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.265 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.529 ' NE2' ' H ' ' A' ' 44' ' ' GLN . 0.1 OUTLIER -97.65 -19.89 17.98 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.004 0.43 . . . . 0.0 109.969 179.222 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.822 HD13 HD13 ' A' ' 40' ' ' LEU . 44.8 mm -56.69 -61.39 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.668 178.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -59.58 -14.76 14.59 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.822 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.987 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -77.73 -37.58 24.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -178.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.826 ' CZ3' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -76.52 -33.41 58.6 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 118.505 -1.278 . . . . 0.0 111.975 -179.154 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.789 ' CZ ' ' CZ3' ' A' ' 48' ' ' TRP . 5.4 m-85 -66.94 -42.68 84.88 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 119.675 -0.81 . . . . 0.0 109.09 178.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.526 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 6.3 pt20 -62.84 -31.27 72.25 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -80.43 -31.71 37.47 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.642 178.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.5 mtmm -62.28 -29.36 70.37 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.453 179.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.31 26.6 7.57 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.829 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -97.69 23.42 7.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.186 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -159.01 29.61 0.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.772 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -164.45 42.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.211 0.529 . . . . 0.0 110.865 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.79 -46.82 0.11 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.787 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -59.34 -38.36 80.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.901 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 73.9 m . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.922 179.928 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 N-CA-C 112.479 -0.248 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -83.09 172.29 12.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.859 0.361 . . . . 0.0 110.882 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 63.52 47.4 3.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.814 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.6 mtpt -141.17 48.42 1.68 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.96 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.413 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 20.4 mtt180 -137.2 139.36 27.87 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.981 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.445 ' HB3' ' N ' ' A' ' 9' ' ' SER . 51.5 Cg_exo -56.11 -161.36 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.616 2.211 . . . . 0.0 112.404 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -112.3 30.38 7.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.088 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.594 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -176.95 -71.03 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.054 179.562 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.594 ' H ' HG23 ' A' ' 6' ' ' THR . . . -173.11 33.27 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.269 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.568 ' CD1' HD11 ' A' ' 13' ' ' LEU . 0.0 OUTLIER 158.25 122.72 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.995 -1.002 . . . . 0.0 108.902 -179.577 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.445 ' N ' ' HB3' ' A' ' 4' ' ' PRO . 3.9 p -66.72 158.1 31.05 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.383 -179.459 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.552 ' HA ' HD22 ' A' ' 13' ' ' LEU . 37.0 m -47.89 -31.23 4.88 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.209 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -53.76 -30.85 46.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.805 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.473 ' CB ' ' HB2' ' A' ' 8' ' ' PHE . 5.9 mm-40 -83.38 -45.06 14.15 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.13 179.08 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.608 HD13 ' N ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -64.72 -30.31 71.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.741 179.082 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.76 -18.1 45.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.737 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -52.46 36.47 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.577 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.26 -33.65 72.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.052 0.453 . . . . 0.0 110.582 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.637 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.9 OUTLIER -66.77 -54.41 23.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.2 179.491 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -61.49 -29.94 70.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.421 179.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.81 -50.62 62.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.875 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.637 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.9 OUTLIER -82.38 -24.55 34.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.888 179.853 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -54.11 -25.97 24.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.118 0.485 . . . . 0.0 109.831 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.601 ' C ' HD21 ' A' ' 26' ' ' LEU . 0.2 OUTLIER -97.52 19.28 13.67 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.662 179.201 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.771 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -163.02 37.38 0.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.145 0.497 . . . . 0.0 110.762 179.618 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.14 -38.34 1.23 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.12 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.557 ' CE1' HD23 ' A' ' 26' ' ' LEU . 19.6 p90 -94.27 -44.98 7.7 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.596 -178.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.771 HD21 ' HA ' ' A' ' 23' ' ' ASN . 0.3 OUTLIER -49.29 -29.64 6.25 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.358 0.599 . . . . 0.0 110.102 -179.564 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.412 ' H ' HG23 ' A' ' 27' ' ' THR . 1.2 p -57.79 -22.04 45.06 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.114 178.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -133.42 10.18 4.06 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.611 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -123.79 -40.65 2.3 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-O 120.969 0.414 . . . . 0.0 110.921 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.57 -12.51 10.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.085 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.683 ' CD ' HG21 ' A' ' 45' ' ' ILE . 3.6 ttt180 -56.96 -23.74 47.91 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.848 0.356 . . . . 0.0 110.81 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.01 -19.37 40.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.281 179.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.51 -46.24 11.04 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.27 179.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.893 HD22 ' CH2' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -63.51 -59.14 5.03 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.914 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.604 ' CB ' HD11 ' A' ' 45' ' ' ILE . 29.5 t -39.38 -32.76 0.13 Allowed 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.356 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.5 -27.82 41.44 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.194 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 34' ' ' LEU . 0.6 OUTLIER -73.39 -60.84 2.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.889 179.899 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 1.159 HD23 HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -56.29 -53.44 57.21 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.099 0.476 . . . . 0.0 110.41 179.846 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 114.12 43.15 0.8 Allowed Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.723 -179.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 1.159 HD11 HD23 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -129.63 -160.93 1.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.992 0.425 . . . . 0.0 111.398 -179.383 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.43 ' OD1' ' N ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -119.46 -91.58 0.55 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.16 -179.299 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.419 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 1.2 mp0 -136.77 -45.7 0.59 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.765 0.317 . . . . 0.0 111.333 -179.165 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.961 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -66.36 -11.76 52.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.265 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.523 ' NE2' ' H ' ' A' ' 44' ' ' GLN . 0.4 OUTLIER -103.39 -21.33 13.82 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.464 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.904 HG22 ' HE2' ' A' ' 49' ' ' PHE . 42.5 mm -57.41 -61.14 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.473 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 9.4 ttmt -57.56 -17.0 11.73 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.757 178.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.961 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -77.3 -34.83 21.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 -178.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.893 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -79.83 -32.4 40.62 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 118.685 -1.206 . . . . 0.0 111.611 -179.488 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.904 ' HE2' HG22 ' A' ' 45' ' ' ILE . 3.7 m-85 -65.71 -41.49 92.24 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 119.655 -0.818 . . . . 0.0 109.179 178.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.593 ' O ' ' HB2' ' A' ' 54' ' ' ALA . 5.1 pt20 -61.36 -26.33 67.75 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 121.075 0.464 . . . . 0.0 109.805 179.25 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -88.89 -30.66 18.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.924 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.4 -27.88 61.7 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.634 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.16 37.96 2.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.813 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.593 ' HB2' ' O ' ' A' ' 50' ' ' GLN . . . -59.3 -37.71 78.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.173 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.17 31.11 19.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.523 HG22 ' HB1' ' A' ' 54' ' ' ALA . 0.6 OUTLIER -135.55 42.87 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.204 0.526 . . . . 0.0 110.99 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.6 mmt180 -129.74 -35.21 1.69 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.745 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.17 52.74 2.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.968 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.973 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.16 0 N-CA-C 112.514 -0.234 . . . . 0.0 112.514 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -168.46 -174.39 2.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.786 0.327 . . . . 0.0 110.915 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 64.3 47.68 3.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.866 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -146.91 47.5 1.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.915 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.491 ' O ' HG23 ' A' ' 6' ' ' THR . 51.6 mtt85 -135.66 152.66 76.57 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.827 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.779 ' O ' HG22 ' A' ' 6' ' ' THR . 61.2 Cg_endo -73.11 160.11 46.18 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.532 2.155 . . . . 0.0 112.193 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 62.3 mtt85 56.26 42.51 27.85 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.483 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.779 HG22 ' O ' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -177.9 -70.37 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.349 -179.587 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.658 ' H ' HG23 ' A' ' 6' ' ' THR . . . -83.57 -27.18 29.45 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.703 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.971 ' CD2' HD22 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -174.86 105.34 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.035 179.683 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.557 ' O ' ' CB ' ' A' ' 10' ' ' SER . 0.7 OUTLIER -100.11 42.78 1.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.031 -179.045 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.811 ' H ' HD21 ' A' ' 13' ' ' LEU . 5.1 t 93.37 -26.03 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.797 179.115 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -91.05 9.8 29.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.927 -178.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.56 ' HG2' ' HB3' ' A' ' 8' ' ' PHE . 10.4 tp60 -126.55 -9.26 6.24 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.893 0.378 . . . . 0.0 110.835 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.971 HD22 ' CD2' ' A' ' 8' ' ' PHE . 0.2 OUTLIER -115.11 -24.45 8.53 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 179.293 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.9 -20.85 62.68 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.946 178.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -69.21 -29.68 67.69 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.562 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.412 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . . . -61.29 -34.0 74.49 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.942 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.636 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 18.9 mttt -58.08 -42.92 86.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.595 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 1.5 ttm-85 -78.26 -32.5 49.67 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.354 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.412 ' HB2' ' HA ' ' A' ' 16' ' ' ALA . 0.3 OUTLIER -69.39 -42.73 74.74 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.287 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.636 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.4 OUTLIER -86.42 -22.05 26.78 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.22 -179.642 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -48.09 -53.32 16.92 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.834 0.35 . . . . 0.0 110.818 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -78.7 -13.51 59.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.048 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.55 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER -103.19 32.47 3.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.248 0.547 . . . . 0.0 109.803 179.701 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.45 -38.12 2.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.745 -178.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.429 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 8.8 p90 -92.68 -36.99 12.64 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.397 -178.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.55 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -53.94 -9.98 0.29 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.331 -179.944 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.527 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 0.5 OUTLIER -83.16 -22.69 33.2 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.649 179.617 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -133.09 16.04 4.18 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.069 178.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.0 tpt180 -121.26 -55.97 1.93 Allowed 'General case' 0 C--O 1.231 0.099 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.503 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.424 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -120.07 4.1 10.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.135 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.527 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.3 OUTLIER -56.86 -28.37 61.65 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 121.009 0.433 . . . . 0.0 110.318 179.454 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -79.13 -20.41 48.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.171 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.23 -44.99 11.04 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.663 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.831 HD22 HD21 ' A' ' 38' ' ' LEU . 0.6 OUTLIER -57.77 -45.82 85.42 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.787 179.107 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.557 ' HA ' HD11 ' A' ' 45' ' ' ILE . 1.8 t -48.01 -26.64 1.86 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.093 179.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.47 -10.58 21.99 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.509 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -76.3 -61.83 1.82 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.745 0.307 . . . . 0.0 111.062 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.931 HD23 ' CD1' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -71.36 -47.27 57.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.117 0.484 . . . . 0.0 110.239 179.66 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 123.35 4.47 8.3 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.465 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.931 ' CD1' HD23 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -106.71 -167.99 1.36 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.955 0.407 . . . . 0.0 111.208 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.611 ' O ' HG12 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -113.8 171.62 7.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.894 -179.888 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.47 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 49.5 mt-10 -52.78 -39.0 61.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.575 -179.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.931 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -56.72 -23.5 42.86 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.316 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.548 ' HA ' ' HB ' ' A' ' 47' ' ' ILE . 0.8 OUTLIER -107.66 -21.77 12.75 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.666 179.687 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.935 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 10.8 mm -57.32 -57.79 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.28 179.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.444 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -59.84 -20.05 54.65 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.151 178.093 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.931 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.4 mp -79.2 -46.73 23.22 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -178.375 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.935 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 25.2 p-90 -66.54 -30.17 70.42 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 119.003 -1.079 . . . . 0.0 111.958 -177.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.747 ' HE2' HG22 ' A' ' 45' ' ' ILE . 21.5 m-85 -64.17 -53.52 48.09 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 177.083 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.839 ' O ' ' HB2' ' A' ' 54' ' ' ALA . 10.4 pt20 -56.72 -25.65 55.0 Favored 'General case' 0 N--CA 1.457 -0.087 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.109 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.2 m-20 -86.09 -30.77 22.32 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.216 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.13 -9.28 59.83 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.095 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.32 48.02 1.67 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.0 0.428 . . . . 0.0 110.816 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.839 ' HB2' ' O ' ' A' ' 50' ' ' GLN . . . -119.82 -64.41 1.27 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.171 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.01 33.25 17.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.585 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.484 ' O ' HG22 ' A' ' 56' ' ' ILE . 30.7 mt -155.57 60.54 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.528 0.68 . . . . 0.0 110.72 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.9 mtt180 -145.98 -46.85 0.2 Allowed 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.77 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.5 mpt_? -54.76 -30.91 57.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.968 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.895 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -96.96 40.44 1.14 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.832 0.349 . . . . 0.0 110.919 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 61.87 46.11 7.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.772 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.26 46.03 1.42 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.742 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.0 mtt180 179.57 162.16 0.8 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.636 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -76.62 -165.44 0.32 Allowed 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.473 2.116 . . . . 0.0 112.167 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -106.85 31.82 5.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.267 0.556 . . . . 0.0 111.196 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.602 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -178.46 -69.59 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.801 179.578 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.602 ' H ' HG23 ' A' ' 6' ' ' THR . . . -159.52 -42.89 0.05 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.954 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.688 ' HD2' HD22 ' A' ' 13' ' ' LEU . 1.2 p90 -150.78 96.33 2.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.729 178.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.442 ' O ' ' CB ' ' A' ' 10' ' ' SER . 37.6 m -133.33 23.41 4.09 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.635 -0.426 . . . . 0.0 112.097 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.442 ' CB ' ' O ' ' A' ' 9' ' ' SER . 0.7 OUTLIER 164.67 -59.65 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 178.351 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -69.2 -22.84 63.87 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -178.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.792 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -100.2 -8.36 23.65 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.782 0.325 . . . . 0.0 111.14 -179.848 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.965 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -115.39 -2.8 12.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.037 179.31 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -106.64 -28.52 10.17 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.8 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.418 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 5.9 mtp180 -112.82 -16.45 12.73 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.71 -179.6 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.792 ' HB3' ' O ' ' A' ' 12' ' ' GLN . . . -95.61 22.48 7.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.804 0.335 . . . . 0.0 111.183 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.459 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -165.15 21.29 0.05 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.367 -179.707 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.53 ' HA ' ' ND2' ' A' ' 21' ' ' ASN . 0.0 OUTLIER -165.26 -51.35 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.737 0.303 . . . . 0.0 111.252 -179.895 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.418 ' HB2' ' HA ' ' A' ' 15' ' ' ARG . 2.4 mm-40 -71.32 -25.34 62.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.204 -179.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.52 ' C ' ' CD1' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -76.65 -28.06 55.87 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.063 -179.914 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.53 ' ND2' ' HA ' ' A' ' 18' ' ' ARG . 3.7 p30 -78.86 7.79 6.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.773 0.32 . . . . 0.0 111.165 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.453 ' HA ' ' CE1' ' A' ' 25' ' ' TYR . 30.2 mm-40 -128.76 5.64 5.53 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.413 179.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.476 ' O ' ' CG ' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -152.48 13.09 0.55 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.039 -179.13 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.972 ' O ' HG23 ' A' ' 27' ' ' THR . 0.0 OUTLIER -138.22 -59.29 0.64 Allowed 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.354 0.597 . . . . 0.0 110.575 179.792 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.501 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 1.6 p90 -45.6 -29.87 1.33 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.013 179.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.56 HD23 ' C ' ' A' ' 24' ' ' ARG . 2.6 pt? -57.26 -10.8 1.41 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.76 -178.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.972 HG23 ' O ' ' A' ' 24' ' ' ARG . 1.3 p -93.51 -5.77 48.32 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.301 0.572 . . . . 0.0 109.63 179.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -148.51 22.35 1.03 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.015 179.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.408 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -151.59 -39.09 0.12 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.214 -179.524 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.417 ' H ' ' HA ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -128.9 32.2 4.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.024 179.645 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.556 ' HB3' ' HA ' ' A' ' 27' ' ' THR . 0.0 OUTLIER -96.58 -25.38 15.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.759 -179.7 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -99.62 -8.22 24.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.131 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -99.99 -38.68 8.49 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 178.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.994 HD21 ' CZ2' ' A' ' 48' ' ' TRP . 3.6 tt -68.01 -52.72 32.42 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.271 -1.331 . . . . 0.0 109.254 178.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.578 ' HA ' HD11 ' A' ' 38' ' ' LEU . 10.7 t -58.75 -20.71 51.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.443 179.066 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 75.2 m -91.1 -16.84 27.16 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.47 ' HG3' ' HG ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -100.82 23.56 10.42 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.381 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.892 HD13 HD12 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -166.94 16.39 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.617 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 45.59 32.89 4.33 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.025 -0.607 . . . . 0.0 113.351 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.933 HD13 ' CE2' ' A' ' 48' ' ' TRP . 11.6 mt -99.87 142.94 30.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.86 0.362 . . . . 0.0 110.43 179.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.473 ' O ' HG12 ' A' ' 45' ' ' ILE . 0.7 OUTLIER -68.41 141.14 55.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.247 -179.541 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.99 -33.76 18.89 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 121.184 0.516 . . . . 0.0 110.428 179.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.841 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -80.46 -33.01 37.03 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.778 0.799 . . . . 0.0 109.739 178.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.632 ' NE2' HD22 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -77.44 -16.38 58.82 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.457 -179.635 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.783 HG22 ' HE2' ' A' ' 49' ' ' PHE . 16.7 mm -62.43 -49.28 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.003 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 22.3 mtmt -70.86 -4.39 24.05 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.946 178.209 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.841 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.5 mp -86.45 -32.92 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -178.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.994 ' CZ2' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -78.81 -44.99 21.89 Favored 'General case' 0 N--CA 1.461 0.078 0 C-N-CA 118.113 -1.435 . . . . 0.0 111.141 179.689 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.783 ' HE2' HG22 ' A' ' 45' ' ' ILE . 6.0 m-85 -55.52 -43.86 76.13 Favored 'General case' 0 CA--C 1.519 -0.23 0 C-N-CA 120.104 -0.638 . . . . 0.0 109.625 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.49 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 4.6 pt20 -61.47 -24.77 66.8 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.177 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -90.25 -30.94 17.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.355 179.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.76 -29.04 44.89 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.695 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.41 25.95 7.76 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.849 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -93.54 -21.83 19.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.332 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 66.88 48.08 1.37 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.94 0.4 . . . . 0.0 110.843 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.1 tt -128.19 42.15 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.999 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -145.12 -68.7 0.3 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.769 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 40.7 46.0 2.16 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.648 179.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 26.3 p . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.875 -179.976 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 112.539 -0.224 . . . . 0.0 112.539 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -175.39 139.16 0.43 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.821 0.343 . . . . 0.0 110.921 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -177.02 43.0 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.901 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.21 45.79 8.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.844 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.93 133.84 21.52 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.898 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -84.92 -168.08 0.48 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.658 2.239 . . . . 0.0 112.408 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 18.2 mtt85 -141.51 47.01 1.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.779 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.522 HG23 ' N ' ' A' ' 7' ' ' ALA . 3.3 t -144.81 -51.33 0.28 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.832 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.522 ' N ' HG23 ' A' ' 6' ' ' THR . . . -64.02 -27.96 69.47 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.829 ' CD2' HD22 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -178.8 107.73 0.04 OUTLIER 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.942 179.039 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.546 ' O ' ' CB ' ' A' ' 10' ' ' SER . 92.2 p -102.77 42.47 1.15 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.519 -179.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.875 ' H ' HD21 ' A' ' 13' ' ' LEU . 5.1 m 97.19 -30.23 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.074 179.615 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -76.68 -20.71 56.31 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.875 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.05 1.58 47.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.834 0.35 . . . . 0.0 111.426 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.905 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -120.56 -29.22 4.78 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.191 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.26 -29.47 53.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.077 178.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.65 -25.08 16.9 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.736 179.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -87.05 -9.08 56.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.189 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.65 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 33.2 mttm -106.48 -46.07 4.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.057 0.456 . . . . 0.0 110.038 179.548 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.413 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 8.1 ttp180 -61.77 -29.89 70.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.399 179.186 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -63.49 -50.02 71.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.808 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.65 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.4 p90 -83.66 -25.7 30.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.063 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.436 ' O ' ' CD1' ' A' ' 25' ' ' TYR . 1.3 m-80 -52.93 -20.83 3.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.801 0.334 . . . . 0.0 110.317 178.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.57 14.96 25.23 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.55 179.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.549 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -153.76 31.11 0.46 Allowed 'General case' 0 N--CA 1.461 0.124 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.677 ' O ' HG23 ' A' ' 27' ' ' THR . 0.5 OUTLIER -146.92 -46.01 0.18 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.761 0.791 . . . . 0.0 109.925 179.521 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.487 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 4.2 p90 -54.78 -38.2 66.97 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.596 -1.184 . . . . 0.0 110.337 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.51 HD23 ' H ' ' A' ' 26' ' ' LEU . 1.9 pt? -53.15 -26.77 18.16 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.696 -179.301 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.677 HG23 ' O ' ' A' ' 24' ' ' ARG . 6.6 p -67.01 -17.68 65.03 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.418 178.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -135.75 19.07 3.28 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.783 178.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.46 -46.71 1.75 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.664 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.412 ' HG3' ' HB2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -135.8 11.33 3.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.499 179.993 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.475 ' N ' ' O ' ' A' ' 26' ' ' LEU . 1.4 ttm180 -64.66 -34.65 78.79 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.124 0.488 . . . . 0.0 110.111 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -76.91 -10.2 59.21 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.962 179.052 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.85 -15.24 16.28 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.817 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.785 ' O ' HD13 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -102.0 -3.1 28.26 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.47 179.513 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.654 ' HA ' HD11 ' A' ' 45' ' ' ILE . 3.1 t -112.79 -3.18 14.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.637 179.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -116.27 -23.21 8.49 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.237 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.544 ' C ' HD12 ' A' ' 38' ' ' LEU . 0.7 OUTLIER -91.3 15.52 11.86 Favored 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 111.736 0.272 . . . . 0.0 111.736 -179.72 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.831 ' N ' HD12 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -158.89 23.11 0.21 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.721 0.296 . . . . 0.0 111.224 -179.08 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 53.2 22.61 14.63 Favored Glycine 0 CA--C 1.518 0.254 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.941 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.746 HD12 HD13 ' A' ' 38' ' ' LEU . 6.4 mt -89.75 -171.39 3.16 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.008 0.432 . . . . 0.0 110.828 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.524 ' O ' HG12 ' A' ' 45' ' ' ILE . 1.7 t30 -133.47 140.29 47.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.418 178.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -46.97 -27.97 1.47 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.086 0.47 . . . . 0.0 110.948 -179.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.586 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -78.85 -40.42 32.71 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.461 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.597 ' HA ' HD13 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -84.64 -11.8 55.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.353 -179.473 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.845 HG22 ' CE2' ' A' ' 49' ' ' PHE . 20.4 mm -55.77 -52.96 42.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.639 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.552 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 38.4 mtmt -63.3 -16.26 59.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.248 177.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.597 HD13 ' HA ' ' A' ' 44' ' ' GLN . 1.3 mp -79.94 -44.4 22.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -178.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.755 ' CZ2' HD22 ' A' ' 34' ' ' LEU . 13.3 p-90 -71.36 -27.38 63.31 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 118.645 -1.222 . . . . 0.0 111.95 -178.284 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.845 ' CE2' HG22 ' A' ' 45' ' ' ILE . 23.0 m-85 -66.25 -51.07 61.16 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 177.01 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.492 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.3 pt20 -58.05 -25.84 61.72 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.021 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -87.24 -30.7 20.74 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.017 179.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.1 mmtp -70.59 -29.19 65.54 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.678 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -118.06 31.61 6.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.847 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.438 ' HB2' ' O ' ' A' ' 50' ' ' GLN . . . -83.06 -46.1 13.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.048 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.95 48.28 3.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.816 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -128.01 42.36 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.934 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -121.01 -34.27 3.56 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.918 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.62 -5.33 47.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.445 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 23.8 p . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.185 -0.912 . . . . 0.0 111.109 -179.984 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.524 -0.231 . . . . 0.0 112.524 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -89.09 -59.53 2.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.796 0.332 . . . . 0.0 110.887 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -176.2 54.58 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.835 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.85 49.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.929 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.2 132.62 21.99 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.919 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -85.85 -175.25 1.8 Allowed 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.721 2.281 . . . . 0.0 112.152 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.453 ' O ' ' HB ' ' A' ' 6' ' ' THR . 31.6 mtt180 -109.04 27.39 9.55 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.417 0.627 . . . . 0.0 111.106 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.524 ' O ' ' HB2' ' A' ' 7' ' ' ALA . 3.1 t 178.43 -40.59 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.126 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.524 ' HB2' ' O ' ' A' ' 6' ' ' THR . . . 165.81 -26.25 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.851 -179.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.948 ' CD2' HD22 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -152.0 92.75 1.76 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.97 179.407 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.551 ' O ' ' CB ' ' A' ' 10' ' ' SER . 1.2 m -88.48 40.35 0.96 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.778 -179.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.809 ' H ' HD21 ' A' ' 13' ' ' LEU . 4.6 t 95.22 -29.73 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.03 179.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -75.61 -15.95 60.28 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.531 -179.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.06 -0.35 33.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.891 0.376 . . . . 0.0 111.484 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.948 HD22 ' CD2' ' A' ' 8' ' ' PHE . 0.1 OUTLIER -122.41 -31.65 3.75 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.338 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.7 -26.15 63.29 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.198 178.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -76.03 -38.35 57.33 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.48 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -74.18 -39.99 62.83 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.241 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.683 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 14.7 mttm -63.43 -43.91 96.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.211 179.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -74.18 -31.44 62.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.156 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -66.15 -46.65 76.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.824 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.683 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.6 OUTLIER -83.25 -25.71 31.4 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.862 179.885 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -51.24 -30.33 17.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.04 0.448 . . . . 0.0 110.344 179.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.534 ' O ' ' ND2' ' A' ' 23' ' ' ASN . 38.5 mt-10 -118.25 13.66 13.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.613 179.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.742 ' HA ' HD21 ' A' ' 26' ' ' LEU . 9.6 m120 -139.92 50.37 1.74 Allowed 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.314 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.1 ttm180 -138.29 -34.02 0.66 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 -177.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.591 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 13.3 p90 -110.47 -50.25 2.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.724 0.297 . . . . 0.0 111.368 -178.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.742 HD21 ' HA ' ' A' ' 23' ' ' ASN . 1.4 pt? -45.64 -34.61 3.55 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.364 0.602 . . . . 0.0 110.005 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.44 ' HB ' ' NH1' ' A' ' 31' ' ' ARG . 1.1 p -52.07 -25.69 9.27 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.884 178.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -132.1 27.94 4.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.878 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.99 -46.28 0.35 Allowed 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.016 -179.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.517 ' HG2' ' O ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -113.14 -18.27 12.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.011 -179.627 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.44 ' NH1' ' HB ' ' A' ' 27' ' ' THR . 5.6 ttm180 -50.46 -30.97 13.91 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.049 0.452 . . . . 0.0 110.553 179.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -72.95 -35.12 66.9 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.192 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.472 ' HG3' ' HG2' ' A' ' 30' ' ' ARG . 0.5 OUTLIER -74.29 -37.63 63.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.021 179.34 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.894 ' O ' HD22 ' A' ' 38' ' ' LEU . 5.8 mt -64.22 -50.09 69.39 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.928 179.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.7 t -45.69 -28.7 1.06 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.263 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -97.22 -14.1 21.62 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.74 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.505 ' HB3' HD13 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -84.66 -66.56 0.88 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.6 0.238 . . . . 0.0 111.258 -179.713 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.916 HD23 ' CD1' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -60.25 -50.12 74.93 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.033 0.444 . . . . 0.0 110.65 -179.919 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 127.5 -1.93 7.04 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.359 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.916 ' CD1' HD23 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -96.48 -161.75 0.9 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.913 0.387 . . . . 0.0 110.944 179.867 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.406 ' HB3' HE22 ' A' ' 44' ' ' GLN . 34.3 t30 -112.26 -100.75 0.41 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.519 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -133.21 -47.45 0.84 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.779 0.323 . . . . 0.0 110.916 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.991 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -60.97 -14.79 25.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.894 179.336 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.578 ' NE2' ' H ' ' A' ' 44' ' ' GLN . 0.8 OUTLIER -102.32 -20.65 14.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.266 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.885 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 8.4 mm -60.42 -59.61 3.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.635 178.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.454 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 15.9 mtmt -58.11 -17.82 20.91 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.26 178.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.991 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.4 mp -80.26 -43.21 21.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -178.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.885 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 32.4 p-90 -70.72 -26.95 63.63 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 118.904 -1.119 . . . . 0.0 112.197 -177.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.764 ' HE2' HG22 ' A' ' 45' ' ' ILE . 10.8 m-85 -67.97 -49.33 62.34 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.184 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 47' ' ' ILE . 7.9 pt20 -59.35 -25.67 64.42 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.996 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -89.04 -29.4 19.48 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.946 178.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -73.78 -28.84 61.86 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.683 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -101.97 26.29 7.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.873 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -84.77 -28.71 26.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.102 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp 62.66 35.03 14.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.827 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -175.95 42.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.123 0.487 . . . . 0.0 110.944 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -174.77 -68.01 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.814 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.29 84.96 0.11 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.899 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.7 p . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.165 -0.921 . . . . 0.0 110.93 -179.995 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -135.93 -45.94 0.65 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.889 0.376 . . . . 0.0 110.996 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 65.4 47.23 2.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.795 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.9 tttm -176.41 53.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.863 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.453 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -129.12 120.13 20.04 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.958 179.985 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.492 ' HB3' ' N ' ' A' ' 9' ' ' SER . 25.0 Cg_exo -64.26 -161.39 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.698 2.265 . . . . 0.0 112.293 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 8.8 mtt-85 -117.66 31.23 6.83 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.004 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.6 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -175.11 -70.92 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.481 179.489 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.6 ' H ' HG23 ' A' ' 6' ' ' THR . . . -173.7 28.99 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.709 179.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.974 ' CD2' HD22 ' A' ' 13' ' ' LEU . 0.0 OUTLIER 163.41 115.77 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.781 -179.725 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.492 ' N ' ' HB3' ' A' ' 4' ' ' PRO . 1.0 OUTLIER -87.86 37.91 0.82 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -178.508 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.553 ' H ' HD21 ' A' ' 13' ' ' LEU . 3.5 m 85.55 -28.27 0.08 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.911 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -72.23 -33.32 67.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.875 -179.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.416 ' HB2' ' HB2' ' A' ' 8' ' ' PHE . 0.2 OUTLIER -77.23 -4.47 44.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.332 179.911 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.974 HD22 ' CD2' ' A' ' 8' ' ' PHE . 0.1 OUTLIER -121.0 -15.13 8.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.611 179.705 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -112.23 -21.81 11.25 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.157 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.3 ttm180 -118.47 -55.78 2.19 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.681 0.277 . . . . 0.0 111.207 -179.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.0 -35.13 66.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.885 0.374 . . . . 0.0 110.728 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.9 OUTLIER -71.06 -57.73 4.25 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.342 179.534 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 20.5 mtm180 -60.48 -30.75 69.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.47 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -61.03 -41.23 96.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.838 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.552 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.5 p90 -98.13 -26.01 14.72 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.884 -0.327 . . . . 0.0 111.431 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -44.08 -58.52 2.79 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.915 0.388 . . . . 0.0 111.11 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.461 ' O ' HD13 ' A' ' 26' ' ' LEU . 20.6 mt-10 -73.63 -18.12 61.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.649 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.543 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 1.1 m-80 -106.94 33.46 3.94 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.986 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.95 -33.44 3.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.209 -178.019 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.483 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.2 p90 -100.24 -38.67 8.4 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.524 -178.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.57 HD23 HG23 ' A' ' 27' ' ' THR . 0.5 OUTLIER -54.1 -9.77 0.29 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.346 -179.77 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.57 HG23 HD23 ' A' ' 26' ' ' LEU . 1.0 OUTLIER -84.8 -16.71 40.54 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.871 179.77 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -138.8 15.07 2.69 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.315 179.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.13 -48.14 2.12 Favored 'General case' 0 CA--C 1.522 -0.103 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.379 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.402 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.5 OUTLIER -126.36 2.7 7.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.13 179.654 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.543 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.0 OUTLIER -60.41 -21.25 62.01 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 120.98 0.419 . . . . 0.0 110.741 179.391 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -88.34 -32.92 18.17 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 179.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.28 -36.31 79.18 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.851 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.819 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 12.7 mt -67.12 -60.64 2.45 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.837 179.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.2 t -50.48 -24.85 3.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.392 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 98.9 p -92.66 -33.78 14.23 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.676 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.41 24.39 9.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.707 0.289 . . . . 0.0 111.601 -179.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.714 HD21 ' CD2' ' A' ' 34' ' ' LEU . 1.8 mm? -128.1 -53.87 1.29 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.265 0.555 . . . . 0.0 110.507 179.599 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.71 -3.46 13.37 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.586 -178.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.476 HD13 ' HE1' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -94.92 -160.09 0.76 Allowed 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.399 0.618 . . . . 0.0 111.228 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.406 ' ND2' ' HG3' ' A' ' 42' ' ' GLU . 25.1 t30 -117.55 -80.79 0.61 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.902 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.406 ' HG3' ' ND2' ' A' ' 41' ' ' ASN . 0.1 OUTLIER -160.04 -43.49 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 179.662 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.945 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -67.53 -12.74 61.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.382 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.587 ' NE2' ' H ' ' A' ' 44' ' ' GLN . 1.3 mp0 -102.19 -18.45 15.51 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.942 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 4.0 mm -62.21 -60.07 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.316 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.534 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -55.52 -19.69 10.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.22 178.332 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.945 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -77.85 -47.12 25.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -178.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.942 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 46.6 p-90 -67.67 -28.9 68.09 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 119.577 -0.849 . . . . 0.0 112.412 -177.361 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.719 ' HE2' HG22 ' A' ' 45' ' ' ILE . 17.5 m-85 -62.08 -43.79 98.07 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 177.348 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 47' ' ' ILE . 30.0 mt-30 -50.55 -34.08 24.2 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.04 179.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -83.81 -30.31 26.64 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.071 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.52 -27.92 63.53 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.709 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 -64.57 -28.83 69.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.924 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.91 -3.2 43.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.622 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 73.5 mttt 64.2 48.62 2.85 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.917 0.389 . . . . 0.0 110.807 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.8 tt -126.88 41.84 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.183 0.516 . . . . 0.0 110.943 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.7 mtp-105 -157.23 -45.8 0.07 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.794 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -44.53 95.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.852 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.4 t . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.928 179.951 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 N-CA-C 112.618 -0.193 . . . . 0.0 112.618 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -172.31 -176.99 1.71 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.816 0.341 . . . . 0.0 110.889 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -152.24 46.75 0.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.903 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.9 mttp -161.54 50.06 0.22 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.747 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.511 ' HB2' ' HB3' ' A' ' 7' ' ' ALA . 34.0 mtp180 63.32 126.05 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.013 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 91.3 Cg_endo -94.75 70.22 0.26 Allowed 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 123.122 2.548 . . . . 0.0 112.646 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.705 ' O ' ' HB ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -163.45 50.18 0.15 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.113 179.96 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.705 ' HB ' ' O ' ' A' ' 5' ' ' ARG . 2.1 m 80.25 -12.45 1.04 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.514 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.634 ' O ' ' CD1' ' A' ' 8' ' ' PHE . . . -68.3 -21.49 64.77 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.006 -0.277 . . . . 0.0 110.948 179.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.634 ' CD1' ' O ' ' A' ' 7' ' ' ALA . 2.1 m-30 148.48 110.99 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.43 0 O-C-N 124.059 0.85 . . . . 0.0 110.939 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.532 ' O ' ' CB ' ' A' ' 10' ' ' SER . 52.8 p -158.77 33.6 0.22 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.752 178.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.532 ' CB ' ' O ' ' A' ' 9' ' ' SER . 3.9 m 94.92 -30.67 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.502 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.02 -45.37 58.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.633 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.469 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 0.4 OUTLIER -70.8 -28.62 64.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.536 179.609 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.728 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -79.43 -21.33 45.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.379 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -100.85 -27.26 13.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.023 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -88.38 -47.57 8.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.096 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 12' ' ' GLN . . . -59.63 -42.8 93.53 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.715 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.497 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -63.71 -52.46 60.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.029 179.437 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.408 ' O ' ' ND2' ' A' ' 21' ' ' ASN . 7.8 ttm180 -55.19 -28.87 56.11 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.974 179.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -82.58 -48.45 10.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.52 -178.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.523 ' HA ' ' OD1' ' A' ' 23' ' ' ASN . 0.7 OUTLIER -87.18 -29.33 21.84 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.419 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.457 ' HB3' ' O ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -52.66 -26.08 12.73 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.439 179.818 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -88.42 -12.48 43.05 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.81 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.841 ' HA ' HD22 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -128.4 38.23 4.01 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.11 0.481 . . . . 0.0 110.659 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.12 -45.78 4.82 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.518 0.675 . . . . 0.0 110.897 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.509 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 11.8 p90 -76.18 -42.68 45.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.861 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.841 HD22 ' HA ' ' A' ' 23' ' ' ASN . 1.3 pt? -52.98 -22.12 5.26 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.101 0.477 . . . . 0.0 110.707 -179.063 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.583 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 2.7 p -64.72 -21.35 66.73 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.551 178.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -130.8 11.55 5.19 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.859 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.401 ' HB3' ' CD ' ' A' ' 30' ' ' ARG . 0.3 OUTLIER -110.61 -47.57 3.24 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.729 -179.885 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.594 ' HD3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -144.62 14.7 1.58 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.741 179.695 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.583 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.1 OUTLIER -75.04 -35.69 61.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.016 0.436 . . . . 0.0 109.924 179.352 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.1 mp0 -61.39 -25.64 67.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.952 179.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.536 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -61.37 -37.33 83.0 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.072 179.446 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.788 HD13 ' HZ3' ' A' ' 48' ' ' TRP . 1.0 OUTLIER -73.52 -61.99 1.64 Allowed 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.226 178.705 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.475 ' HB2' HD12 ' A' ' 45' ' ' ILE . 19.7 t -45.65 -27.28 0.76 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.956 178.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.3 t -96.35 -17.47 20.63 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.765 -179.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 34' ' ' LEU . 22.8 mt-10 -121.52 20.52 11.12 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.753 0.311 . . . . 0.0 111.024 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.723 ' CB ' HD11 ' A' ' 40' ' ' LEU . 1.6 mm? -110.12 -55.56 2.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.25 0.548 . . . . 0.0 110.364 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 108.77 35.6 2.37 Favored Glycine 0 N--CA 1.448 -0.536 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.125 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.723 HD11 ' CB ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -122.2 -157.11 0.72 Allowed 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.192 0.52 . . . . 0.0 111.143 -179.165 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -126.11 -106.45 0.33 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.737 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -125.78 -40.1 2.08 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.883 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -77.66 1.89 18.43 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.522 ' NE2' ' N ' ' A' ' 44' ' ' GLN . 1.0 OUTLIER -108.42 -21.07 12.9 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.444 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.831 HG22 ' HE2' ' A' ' 49' ' ' PHE . 32.7 mm -57.39 -59.05 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.907 0 CA-C-O 121.271 0.558 . . . . 0.0 109.711 178.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt -61.09 -16.33 42.79 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.451 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.883 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.3 mp -73.8 -38.68 51.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -178.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.788 ' HZ3' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -69.51 -47.86 62.43 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 118.92 -1.112 . . . . 0.0 111.235 -179.501 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.831 ' HE2' HG22 ' A' ' 45' ' ' ILE . 2.1 m-85 -63.32 -41.41 98.91 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 121.037 -0.265 . . . . 0.0 111.042 -179.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.527 ' HG2' ' HA ' ' A' ' 47' ' ' ILE . 5.0 pt20 -64.04 -26.17 68.44 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.177 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 -90.73 -29.08 17.87 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.345 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.2 mtpp -80.63 -22.64 40.37 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.038 179.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.6 -32.61 11.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.981 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.21 -50.24 23.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.134 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.544 ' O ' HG22 ' A' ' 56' ' ' ILE . 1.6 mptt 61.7 38.2 15.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.877 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.544 HG22 ' O ' ' A' ' 55' ' ' LYS . 0.6 OUTLIER 46.77 36.18 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 CA-C-O 121.523 0.678 . . . . 0.0 110.815 -179.647 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.7 ttm180 -147.35 -48.98 0.18 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.926 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 44.32 36.56 1.63 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.413 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.2 m . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.288 -0.863 . . . . 0.0 110.849 179.983 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.214 0 N-CA-C 112.513 -0.235 . . . . 0.0 112.513 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -60.6 117.87 5.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.903 0.383 . . . . 0.0 110.948 -179.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . 0.553 ' HA ' ' HB1' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -157.79 52.81 0.46 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.912 179.999 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 44.8 pttt -172.5 48.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.831 179.984 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.442 ' H ' ' HB3' ' A' ' 7' ' ' ALA . 59.5 mtt85 -145.48 157.97 51.41 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.881 -179.997 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -68.94 71.3 1.12 Allowed 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.496 2.131 . . . . 0.0 112.294 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.592 ' O ' ' HB ' ' A' ' 6' ' ' THR . 5.3 ttt180 -169.21 56.86 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.722 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.592 ' HB ' ' O ' ' A' ' 5' ' ' ARG . 1.3 m 74.91 -5.44 2.15 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.62 -179.8 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.585 ' O ' ' HB2' ' A' ' 8' ' ' PHE . . . -89.58 25.47 1.99 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.985 0.421 . . . . 0.0 110.295 178.98 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.585 ' HB2' ' O ' ' A' ' 7' ' ' ALA . 69.3 m-85 77.06 111.98 0.07 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.399 179.984 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.528 ' O ' ' CB ' ' A' ' 10' ' ' SER . 29.9 t -165.27 37.77 0.06 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.675 179.256 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.528 ' CB ' ' O ' ' A' ' 9' ' ' SER . 5.8 t 93.97 -29.55 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.487 -179.706 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.04 -59.67 2.64 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.02 179.617 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -61.34 -15.83 39.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.522 177.988 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.622 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -79.2 -37.12 39.0 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.224 179.462 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.39 -29.05 52.99 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.628 179.47 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.06 -44.74 94.5 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.394 179.719 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.96 -26.13 65.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.483 179.284 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.676 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 4.4 mtmm -68.97 -53.5 20.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.207 179.352 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.5 ttp-105 -61.61 -29.28 69.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.051 179.034 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.89 -50.6 63.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.791 -179.894 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.676 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.2 p90 -82.02 -25.09 34.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.035 179.984 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -53.5 -25.46 16.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.999 0.428 . . . . 0.0 110.124 179.274 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.675 ' C ' HD21 ' A' ' 26' ' ' LEU . 1.7 mm-40 -100.75 17.99 20.56 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.98 179.484 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.596 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -159.32 34.17 0.2 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.024 0.44 . . . . 0.0 110.741 179.35 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.453 ' HD2' ' CE1' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -127.76 -36.34 2.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.198 -179.549 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.514 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 25.2 p90 -96.93 -46.41 6.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.748 -178.635 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.675 HD21 ' C ' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -48.58 -31.27 6.33 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.516 0.674 . . . . 0.0 109.641 179.84 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.55 ' HA ' ' HB2' ' A' ' 31' ' ' ARG . 1.4 p -53.65 -24.7 15.08 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.951 178.496 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -133.65 17.69 3.93 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.997 178.769 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.436 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -120.33 -50.0 2.25 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.697 -179.869 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.42 6.59 3.82 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.577 179.99 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.662 ' CG ' HG21 ' A' ' 45' ' ' ILE . 47.4 ttt180 -75.62 -7.34 54.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.701 0.286 . . . . 0.0 111.182 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -94.66 -23.33 17.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.356 0.598 . . . . 0.0 109.484 178.901 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.82 -42.77 21.09 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.888 179.037 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.996 ' CD2' HD21 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -63.51 -58.91 5.49 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.045 179.064 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.513 ' CB ' HD11 ' A' ' 45' ' ' ILE . 32.8 t -41.74 -32.32 0.38 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.272 179.331 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.5 m -89.71 -33.06 16.74 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.846 179.83 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.403 ' N ' ' O ' ' A' ' 34' ' ' LEU . 36.0 tt0 -67.32 -14.75 63.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.467 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.996 HD21 ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -112.04 -44.93 3.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.776 0.322 . . . . 0.0 110.722 -179.763 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 109.73 46.07 0.93 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.912 179.475 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.904 HD11 HD13 ' A' ' 38' ' ' LEU . 0.4 OUTLIER -144.85 -168.51 2.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.755 0.312 . . . . 0.0 111.011 179.689 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.697 ' O ' HG12 ' A' ' 45' ' ' ILE . 4.9 p30 -129.7 -175.15 3.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.86 -179.722 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.521 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 9.0 mt-10 -49.23 -34.69 15.56 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -177.939 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.835 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -63.19 -23.18 67.31 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -178.814 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.558 ' HB2' HD22 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -112.03 -19.13 12.44 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 121.034 -0.266 . . . . 0.0 110.796 -179.272 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.907 HG22 ' HE2' ' A' ' 49' ' ' PHE . 38.8 mm -52.12 -60.73 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 178.845 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.454 ' HG3' HD12 ' A' ' 47' ' ' ILE . 34.6 pttt -59.21 -19.9 49.41 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.661 178.856 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.835 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.7 mp -78.63 -40.78 24.32 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -178.409 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.903 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -72.84 -31.94 65.11 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 118.513 -1.275 . . . . 0.0 112.296 -178.227 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.907 ' HE2' HG22 ' A' ' 45' ' ' ILE . 9.1 m-85 -66.4 -44.66 82.4 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 119.608 -0.837 . . . . 0.0 109.374 178.474 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.529 ' O ' ' HB2' ' A' ' 54' ' ' ALA . 1.5 pt20 -58.63 -27.23 64.51 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.207 179.751 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -88.89 -30.02 19.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.2 179.138 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.9 mmmt -76.41 -28.92 56.86 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.753 179.637 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.64 30.63 6.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.87 179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' A' ' 50' ' ' GLN . . . -71.48 -46.58 59.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.141 179.982 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.408 ' O ' ' HB ' ' A' ' 56' ' ' ILE . 0.4 OUTLIER -86.07 -40.81 15.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.882 179.925 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.408 ' HB ' ' O ' ' A' ' 55' ' ' LYS . 3.8 mt 79.95 69.02 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 121.229 0.537 . . . . 0.0 110.824 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -138.15 -46.81 0.52 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.872 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.3 -41.55 98.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.85 179.946 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.8 p . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.872 -179.965 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.201 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -97.0 136.69 37.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.842 0.353 . . . . 0.0 110.83 -179.914 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 63.4 47.16 4.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.788 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -149.29 48.75 0.97 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.896 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -105.96 164.73 14.38 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.983 -179.962 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.422 ' HB3' ' CB ' ' A' ' 9' ' ' SER . 60.1 Cg_endo -72.12 -166.6 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.593 2.195 . . . . 0.0 112.271 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.7 mtt-85 -117.4 31.68 6.59 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.185 0.516 . . . . 0.0 111.514 -179.959 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.59 ' O ' ' HB2' ' A' ' 7' ' ' ALA . 5.0 t -162.86 -45.53 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.771 179.403 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.59 ' HB2' ' O ' ' A' ' 6' ' ' THR . . . 160.91 -23.36 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.952 -179.689 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.603 ' CD2' HD11 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -161.66 104.59 1.22 Allowed 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.336 179.602 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.492 ' O ' ' CB ' ' A' ' 10' ' ' SER . 3.5 m -81.46 39.4 0.53 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -178.283 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.618 ' HA ' HD22 ' A' ' 13' ' ' LEU . 4.9 t 87.74 -29.51 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.905 179.512 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -64.25 -27.86 69.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.826 179.57 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.472 ' CB ' ' HB3' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -85.44 -44.22 12.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.038 179.333 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.618 HD22 ' HA ' ' A' ' 10' ' ' SER . 0.0 OUTLIER -59.36 -42.03 90.64 Favored 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.49 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.85 -18.72 61.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.875 179.492 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.8 -50.1 22.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.292 -179.768 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.48 -13.99 25.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.89 -179.723 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.514 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.4 OUTLIER -107.42 -38.85 5.82 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.896 0.379 . . . . 0.0 110.589 179.983 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -79.45 -32.59 42.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.375 -179.829 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -57.9 -39.41 77.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.862 -179.755 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.514 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.5 p90 -94.96 -38.02 10.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.417 -179.9 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.452 ' N ' ' CD1' ' A' ' 20' ' ' PHE . 3.3 m-20 -44.87 -40.12 5.97 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.893 0.378 . . . . 0.0 111.109 -179.698 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.779 ' O ' HD13 ' A' ' 26' ' ' LEU . 41.7 tt0 -82.03 -24.24 35.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.626 179.66 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.553 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER -110.62 33.69 4.39 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.562 -179.574 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.503 ' HB3' ' O ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -126.79 -35.45 2.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.32 -178.078 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.418 ' C ' ' H ' ' A' ' 27' ' ' THR . 4.7 p90 -101.89 -34.94 9.19 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.379 -178.211 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.779 HD13 ' O ' ' A' ' 22' ' ' GLU . 0.6 OUTLIER -55.11 -10.12 0.49 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.068 179.725 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.525 HG23 HD23 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -86.73 -16.87 35.11 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.931 179.92 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -140.08 17.74 2.45 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.193 179.218 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -127.41 -53.15 1.37 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.826 -179.559 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.414 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.8 OUTLIER -121.76 3.98 10.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.449 -179.947 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.59 -38.69 69.74 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.069 0.461 . . . . 0.0 110.304 179.669 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -71.88 -46.42 57.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.246 179.253 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.48 -32.85 65.39 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.266 0.555 . . . . 0.0 109.932 179.087 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.822 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 5.0 mt -67.51 -55.95 11.49 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.686 179.845 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.642 ' HA ' HD11 ' A' ' 45' ' ' ILE . 3.8 t -59.34 -21.12 59.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.035 -179.76 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.0 t -95.26 -14.16 24.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.569 -179.643 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -106.12 -29.05 10.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.01 0.433 . . . . 0.0 110.507 179.843 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.603 ' CB ' HD11 ' A' ' 40' ' ' LEU . 4.0 mm? -78.89 -58.55 3.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.749 179.778 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 109.81 15.98 11.34 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.813 -179.114 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.603 HD11 ' CB ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -107.98 -162.64 0.84 Allowed 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.144 0.497 . . . . 0.0 111.361 -179.851 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.44 ' CB ' ' HB2' ' A' ' 44' ' ' GLN . 0.7 OUTLIER -97.3 146.79 24.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.337 -179.783 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -52.19 -36.7 52.65 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 121.218 0.532 . . . . 0.0 109.904 179.573 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.561 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -75.77 -33.97 60.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.104 178.239 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.557 ' O ' ' HB ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -75.82 -13.79 60.29 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.828 179.715 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.884 ' HA ' ' NE1' ' A' ' 48' ' ' TRP . 3.0 mm -65.53 -56.91 13.0 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.494 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.51 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.558 ' HA ' ' CD2' ' A' ' 49' ' ' PHE . 30.4 mtmt -54.45 -18.82 4.67 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.962 177.71 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.561 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -76.1 -46.19 34.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -178.851 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.884 ' NE1' ' HA ' ' A' ' 45' ' ' ILE . 34.4 p-90 -68.19 -28.21 67.06 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 119.553 -0.859 . . . . 0.0 112.651 -177.453 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.788 ' HE2' HG22 ' A' ' 45' ' ' ILE . 12.1 m-85 -63.61 -42.54 98.21 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.542 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -56.78 -33.54 66.76 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.679 179.147 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -83.13 -29.81 28.38 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.126 179.204 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.26 -27.17 62.32 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.7 179.622 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.75 26.93 7.44 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.881 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.97 -35.5 80.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.088 179.985 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.405 ' O ' ' HB ' ' A' ' 56' ' ' ILE . 11.5 tttt -78.05 -47.26 18.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.405 ' HB ' ' O ' ' A' ' 55' ' ' LYS . 3.4 mt 79.53 68.77 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.259 0.552 . . . . 0.0 110.868 -179.718 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -164.61 -48.1 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.711 179.914 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 39.73 43.76 1.19 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.686 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.3 t . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.876 -179.947 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 112.541 -0.224 . . . . 0.0 112.541 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -159.63 77.59 0.69 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.78 0.324 . . . . 0.0 110.891 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -169.95 48.92 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.834 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.8 tmtm? 62.86 46.46 5.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.804 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.21 146.06 0.91 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.794 -179.967 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -81.31 -165.43 0.34 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.682 2.254 . . . . 0.0 112.403 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.421 ' O ' ' HB ' ' A' ' 6' ' ' THR . 26.3 mtt85 -109.48 33.22 4.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.218 0.533 . . . . 0.0 111.081 -179.966 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.717 HG23 ' H ' ' A' ' 7' ' ' ALA . 1.4 t 169.35 -63.94 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.864 179.378 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.717 ' H ' HG23 ' A' ' 6' ' ' THR . . . 175.27 45.87 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.057 -179.71 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.601 ' CD1' HD22 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -159.52 98.17 1.38 Allowed 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 114.725 -1.125 . . . . 0.0 111.518 -178.491 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.62 ' O ' HD23 ' A' ' 13' ' ' LEU . 0.2 OUTLIER -67.3 116.21 7.82 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.878 179.201 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.438 ' HA ' HD21 ' A' ' 13' ' ' LEU . 11.7 t -43.62 -31.4 0.75 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.2 0.524 . . . . 0.0 110.896 179.982 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -75.52 -1.42 24.2 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.069 179.411 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.539 ' N ' ' O ' ' A' ' 9' ' ' SER . 1.0 OUTLIER -112.76 -36.15 5.26 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.583 179.901 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.62 HD23 ' O ' ' A' ' 9' ' ' SER . 0.3 OUTLIER -87.15 -23.04 24.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.552 179.385 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.25 -30.42 70.44 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.545 179.393 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -99.92 -34.22 10.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.664 179.644 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.405 ' O ' ' N ' ' A' ' 20' ' ' PHE . . . -64.58 -33.07 75.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.265 179.435 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.589 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 0.1 OUTLIER -54.21 -26.98 31.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.33 179.288 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.432 ' HA ' ' ND2' ' A' ' 21' ' ' ASN . 1.0 OUTLIER -89.68 -28.64 19.31 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.754 179.668 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -94.06 -8.96 38.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.496 -179.126 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.589 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -117.38 -24.88 7.21 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -179.442 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.492 ' HB3' ' O ' ' A' ' 17' ' ' LYS . 5.8 p30 -50.26 -40.47 48.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.89 0.376 . . . . 0.0 110.739 179.879 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -81.31 -10.64 59.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.983 179.52 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.54 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 0.9 OUTLIER -102.66 32.32 3.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.273 0.559 . . . . 0.0 109.633 179.633 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.85 -42.12 2.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.146 -0.933 . . . . 0.0 111.453 -178.545 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.435 ' C ' ' H ' ' A' ' 27' ' ' THR . 6.9 p90 -88.92 -35.77 16.29 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.279 -178.692 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.54 ' CD2' ' HA ' ' A' ' 23' ' ' ASN . 0.7 OUTLIER -54.26 -9.02 0.24 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.15 0.5 . . . . 0.0 111.371 -179.891 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.484 HG23 HD23 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -88.01 -19.51 27.07 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.927 179.941 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -132.57 12.4 4.48 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.975 178.591 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.22 -44.44 1.14 Allowed 'General case' 0 C--O 1.231 0.098 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.111 179.981 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.427 ' HD3' ' CB ' ' A' ' 26' ' ' LEU . 14.9 mtp180 -110.97 -3.56 15.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.896 179.548 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -11.09 39.38 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.737 0.303 . . . . 0.0 111.066 179.773 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -95.91 -19.78 19.27 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.718 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -86.93 -47.89 8.61 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.994 179.234 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.965 HD22 ' CZ3' ' A' ' 48' ' ' TRP . 0.5 OUTLIER -61.66 -48.35 81.22 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.87 179.764 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.708 ' O ' HD12 ' A' ' 40' ' ' LEU . 6.1 t -50.49 -37.23 37.61 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.892 179.213 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.5 t -98.6 7.7 45.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.472 179.131 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.487 ' C ' HD12 ' A' ' 38' ' ' LEU . 11.5 tt0 -92.88 -38.48 11.7 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.583 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.758 HD22 ' CZ2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -107.82 19.57 19.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.353 -179.406 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 56.25 63.67 5.1 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.478 -0.867 . . . . 0.0 111.455 -179.185 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.734 HD13 ' HZ2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -137.93 -160.33 1.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.203 0.525 . . . . 0.0 111.952 -178.428 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.7 -83.89 0.17 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.001 179.97 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.432 ' HA ' HG12 ' A' ' 45' ' ' ILE . 6.0 mp0 -141.45 -39.54 0.39 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.898 0.38 . . . . 0.0 110.633 -179.588 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.836 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -66.44 -12.96 59.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.691 -179.953 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.514 ' HB2' ' HB3' ' A' ' 40' ' ' LEU . 1.3 mp0 -111.88 -26.26 9.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.804 0.335 . . . . 0.0 110.53 -179.914 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.819 HG22 ' HE1' ' A' ' 49' ' ' PHE . 8.9 mm -60.52 -64.06 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.747 0 CA-C-O 121.352 0.596 . . . . 0.0 110.24 179.574 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -55.72 -21.85 20.76 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.094 -0.957 . . . . 0.0 110.322 179.576 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.836 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.2 mp -64.35 -35.96 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.229 -179.642 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.965 ' CZ3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -71.69 -58.61 3.33 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.485 179.686 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.819 ' HE1' HG22 ' A' ' 45' ' ' ILE . 0.4 OUTLIER -60.26 -25.48 65.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.703 -179.563 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -57.08 -29.95 63.91 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.066 0.46 . . . . 0.0 110.03 179.22 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -88.24 -29.06 20.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.326 179.326 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.47 -26.23 41.74 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.879 179.737 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.2 tpt85 -103.78 27.41 7.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.895 179.904 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -121.33 28.66 7.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.138 179.842 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -109.96 -23.2 11.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.047 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -125.55 41.51 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 121.221 0.534 . . . . 0.0 110.875 179.947 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -172.13 -57.46 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.885 179.959 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.2 103.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.771 179.974 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.898 -179.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 112.44 -0.264 . . . . 0.0 112.44 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -72.7 109.91 6.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 0.0 110.891 179.971 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -171.04 63.38 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.875 179.993 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.8 tttm -173.89 64.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.904 -179.892 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.93 145.01 50.48 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.132 179.929 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.489 ' O ' HG22 ' A' ' 6' ' ' THR . 93.6 Cg_endo -81.6 140.63 11.92 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 123.111 2.541 . . . . 0.0 112.79 -179.5 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 61.85 46.69 6.63 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.946 179.662 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.659 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -170.59 -72.04 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.662 -179.982 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.659 ' H ' HG23 ' A' ' 6' ' ' THR . . . -70.22 -42.98 71.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.752 179.683 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.805 ' CG ' HD21 ' A' ' 13' ' ' LEU . 0.0 OUTLIER 169.22 113.98 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.558 179.716 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.46 ' O ' ' HB2' ' A' ' 10' ' ' SER . 2.4 p -88.19 38.25 0.85 Allowed 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -179.043 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.46 ' HB2' ' O ' ' A' ' 9' ' ' SER . 15.4 m 87.34 -29.92 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.695 179.624 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.33 -36.15 83.18 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.835 179.751 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.458 ' CB ' ' HB3' ' A' ' 8' ' ' PHE . 0.8 OUTLIER -78.94 -28.33 43.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.979 178.985 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.805 HD21 ' CG ' ' A' ' 8' ' ' PHE . 7.6 mt -74.97 -30.77 61.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.344 179.339 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.39 -30.61 30.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.416 -179.812 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.25 -46.55 12.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.182 -179.75 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.409 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . . . -60.01 -44.39 94.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.01 -179.932 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.564 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 1.1 ttmm -52.23 -37.36 54.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.493 179.812 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.5 ttm180 -87.98 -31.74 19.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.238 179.32 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.409 ' HB2' ' HA ' ' A' ' 16' ' ' ALA . 0.1 OUTLIER -64.32 -42.7 96.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.197 -179.811 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.718 ' HA ' ' OD1' ' A' ' 23' ' ' ASN . 3.5 p90 -89.52 -22.66 22.32 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.333 -179.739 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.557 ' HA ' ' CD ' ' A' ' 24' ' ' ARG . 0.3 OUTLIER -52.54 -32.84 42.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.048 0.451 . . . . 0.0 110.415 178.051 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -81.2 -9.06 59.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.382 -179.956 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.718 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -125.91 35.39 4.71 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.214 0.531 . . . . 0.0 111.082 179.814 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.646 ' O ' HG23 ' A' ' 27' ' ' THR . 24.0 mtm105 -100.26 -49.28 4.32 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.754 0.787 . . . . 0.0 110.412 179.853 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.518 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 4.7 p90 -47.75 -39.81 18.9 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.412 -1.267 . . . . 0.0 111.178 -179.876 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.518 ' N ' ' CG ' ' A' ' 25' ' ' TYR . 3.8 pp -51.19 -30.49 17.24 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.862 -179.074 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.646 HG23 ' O ' ' A' ' 24' ' ' ARG . 16.5 p -63.13 -19.27 64.3 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.3 -0.863 . . . . 0.0 109.832 179.163 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -131.94 8.05 4.41 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.481 178.748 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -113.27 -43.69 3.33 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.826 179.937 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.446 ' CG ' ' HB2' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -128.32 -1.36 5.67 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.616 179.853 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.827 ' NE ' HG21 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -72.9 -11.16 60.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.786 0.327 . . . . 0.0 110.981 179.702 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -102.66 -21.23 14.15 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.004 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -81.97 -41.14 21.2 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.112 179.294 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.65 HD13 ' CZ3' ' A' ' 48' ' ' TRP . 10.4 mt -67.79 -59.67 3.13 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.46 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.8 ' OG ' HD11 ' A' ' 45' ' ' ILE . 4.7 t -38.53 -32.94 0.09 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.675 178.756 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.8 t -81.06 -38.32 27.57 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.926 -179.334 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -86.95 -27.24 23.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.814 0.34 . . . . 0.0 111.473 -179.494 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.796 ' HB3' HD22 ' A' ' 40' ' ' LEU . 3.5 mm? -78.32 -2.93 40.45 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.643 -179.667 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 50.64 68.63 1.38 Allowed Glycine 0 C--N 1.334 0.469 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.608 179.884 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.796 HD22 ' HB3' ' A' ' 38' ' ' LEU . 1.9 pt? -153.21 -151.88 0.39 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.285 0.564 . . . . 0.0 111.694 -179.188 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -136.78 -84.12 0.35 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.804 -179.629 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.485 ' HA ' HG13 ' A' ' 45' ' ' ILE . 11.5 tt0 -141.01 -46.77 0.4 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.854 0.359 . . . . 0.0 111.487 -179.297 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.556 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -64.91 -17.43 64.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.716 -179.659 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.77 ' HA ' HD13 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -98.56 -18.14 18.31 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.271 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.937 HD13 ' CZ2' ' A' ' 48' ' ' TRP . 6.8 mm -55.35 -46.61 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.669 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 178.154 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.36 -10.76 59.36 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.869 -1.059 . . . . 0.0 109.755 178.099 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.77 HD13 ' HA ' ' A' ' 44' ' ' GLN . 1.2 mp -73.08 -33.2 41.85 Favored 'Isoleucine or valine' 0 C--N 1.342 0.277 0 C-N-CA 121.016 -0.274 . . . . 0.0 111.234 -179.926 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.937 ' CZ2' HD13 ' A' ' 45' ' ' ILE . 0.0 OUTLIER -70.87 -60.5 2.2 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.322 179.606 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.854 ' HE2' HG22 ' A' ' 45' ' ' ILE . 1.0 OUTLIER -58.84 -30.07 67.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.509 -179.735 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.484 ' O ' ' HB2' ' A' ' 54' ' ' ALA . 4.8 mt-30 -51.0 -26.85 6.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.103 0.478 . . . . 0.0 109.938 178.961 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -84.7 -31.75 23.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.201 179.106 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.5 ttmm -69.42 -29.44 67.17 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.627 179.593 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -109.07 30.47 6.54 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.794 179.946 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.484 ' HB2' ' O ' ' A' ' 50' ' ' GLN . . . -122.12 30.98 6.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.093 -179.985 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.08 31.69 4.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.89 179.944 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.7 tt -177.02 42.64 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.248 0.547 . . . . 0.0 110.994 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.9 ttt180 -135.81 -38.86 0.71 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.876 -179.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.66 60.33 1.66 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.912 179.992 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.887 -179.915 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.163 0 N-CA-C 112.451 -0.26 . . . . 0.0 112.451 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 0' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -110.0 97.4 6.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.809 0.338 . . . . 0.0 110.885 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -163.39 47.73 0.13 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.761 -179.999 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.6 tttt -157.45 47.93 0.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.073 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.3 130.67 5.63 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.94 179.949 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.422 ' HB2' HG22 ' A' ' 6' ' ' THR . 96.3 Cg_endo -86.76 -165.37 0.25 Allowed 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.825 2.35 . . . . 0.0 112.437 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.66 44.08 3.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.154 0.502 . . . . 0.0 110.405 179.739 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.594 HG23 ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -120.88 -78.52 0.59 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.549 -179.945 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.594 ' H ' HG23 ' A' ' 6' ' ' THR . . . -100.65 24.8 8.55 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.0 0.429 . . . . 0.0 110.391 179.265 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.526 ' CE1' ' HB3' ' A' ' 13' ' ' LEU . 3.8 m-85 -141.16 86.91 2.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.803 -179.63 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.483 ' O ' ' CB ' ' A' ' 10' ' ' SER . 18.9 t -111.94 32.42 5.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.045 0.45 . . . . 0.0 111.458 -179.835 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.562 ' H ' HD21 ' A' ' 13' ' ' LEU . 3.5 m 88.38 -27.22 0.06 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.342 179.479 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.54 1.8 57.05 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.966 -178.976 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.69 -18.49 10.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.71 0.29 . . . . 0.0 111.187 179.683 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.565 HD23 ' H ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -104.71 -27.62 11.69 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.922 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.437 ' HB2' ' O ' ' A' ' 10' ' ' SER . . . -58.25 -29.22 65.6 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.295 178.975 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -83.95 -43.73 14.92 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.405 179.444 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.24 -29.31 69.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.332 179.285 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.685 ' HA ' ' CE2' ' A' ' 20' ' ' PHE . 11.2 ttmt -66.91 -56.5 9.99 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.924 179.367 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.8 ttm-85 -57.44 -29.2 63.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.571 179.196 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -69.68 -49.94 48.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.452 -179.559 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.685 ' CE2' ' HA ' ' A' ' 17' ' ' LYS . 1.6 p90 -85.45 -22.2 28.39 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -179.3 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 0.5 OUTLIER -52.49 -22.9 5.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.776 0.322 . . . . 0.0 110.429 179.141 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -105.52 12.9 30.83 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.543 -179.889 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.523 ' OD1' ' HA ' ' A' ' 20' ' ' PHE . 0.7 OUTLIER -151.48 35.23 0.56 Allowed 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 179.621 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.624 ' O ' HG23 ' A' ' 27' ' ' THR . 8.0 mmt180 -148.2 -46.22 0.16 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.774 0.797 . . . . 0.0 109.976 179.556 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.51 ' CG ' ' N ' ' A' ' 26' ' ' LEU . 6.1 p90 -58.02 -39.05 77.39 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.546 -1.206 . . . . 0.0 110.248 179.811 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.573 ' HA ' ' HB3' ' A' ' 29' ' ' ARG . 2.1 pt? -52.67 -30.12 30.22 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.342 -179.564 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.624 HG23 ' O ' ' A' ' 24' ' ' ARG . 3.7 p -64.28 -18.33 64.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.661 178.918 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -137.04 19.91 3.0 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.078 178.829 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.573 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 0.7 OUTLIER -126.1 -41.57 1.92 Allowed 'General case' 0 C--O 1.231 0.11 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.089 -179.454 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.484 ' HD3' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -149.7 19.98 0.91 Allowed 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.766 0.284 . . . . 0.0 111.766 -179.781 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.532 ' HB2' ' HA ' ' A' ' 27' ' ' THR . 0.6 OUTLIER -81.47 -26.11 35.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.858 0.361 . . . . 0.0 110.474 179.687 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -86.46 -21.65 26.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.173 179.145 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.5 -45.14 12.93 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.082 179.344 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.901 HD22 ' CH2' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -62.88 -57.65 10.08 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.814 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.584 ' CB ' HD11 ' A' ' 45' ' ' ILE . 29.9 t -40.53 -32.98 0.23 Allowed 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.186 179.718 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.36 -30.08 47.79 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.856 179.727 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.564 ' N ' ' O ' ' A' ' 34' ' ' LEU . 31.5 mt-10 -71.28 -57.13 4.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.811 179.812 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 1.054 HD23 HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.39 -47.43 85.47 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.125 0.488 . . . . 0.0 110.34 179.7 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.31 30.9 5.48 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.333 -178.837 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 1.054 HD11 HD23 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -126.61 -168.29 1.84 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.019 0.437 . . . . 0.0 111.343 -179.48 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.6 ' O ' HG12 ' A' ' 45' ' ' ILE . 0.1 OUTLIER -124.09 176.83 6.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.064 179.878 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.44 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 13.6 mp0 -46.85 -30.93 2.74 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.006 -178.675 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.712 ' O ' HD13 ' A' ' 47' ' ' ILE . . . -63.63 -19.85 65.2 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.115 -179.481 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.663 ' CB ' HD22 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -118.72 -20.9 8.09 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.557 -179.023 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.875 HG22 ' HE2' ' A' ' 49' ' ' PHE . 46.9 mm -50.81 -58.08 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.473 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.431 ' HA ' ' HD2' ' A' ' 49' ' ' PHE . 1.5 mtmt -60.34 -25.08 65.55 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.481 178.391 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.712 HD13 ' O ' ' A' ' 43' ' ' ALA . 1.6 mp -70.93 -39.31 75.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -178.585 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.901 ' CH2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -74.45 -40.6 61.81 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 118.401 -1.32 . . . . 0.0 111.907 -178.859 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.875 ' HE2' HG22 ' A' ' 45' ' ' ILE . 2.8 m-85 -59.92 -33.74 72.27 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.347 -0.941 . . . . 0.0 108.663 178.025 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.4 ' NE2' ' O ' ' A' ' 46' ' ' LYS . 0.9 OUTLIER -49.32 -27.81 4.26 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.909 179.163 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -88.71 -31.12 18.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.218 179.319 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.8 mmtm -77.82 -27.31 49.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.86 179.707 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.52 -41.63 60.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.783 179.887 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.699 ' HB1' ' HB3' ' A' ' 58' ' ' ARG . . . -74.13 -22.62 59.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.197 179.961 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.558 ' O ' HG22 ' A' ' 56' ' ' ILE . 11.5 mmtt 61.95 32.76 17.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.844 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.558 HG22 ' O ' ' A' ' 55' ' ' LYS . 0.6 OUTLIER 47.07 36.13 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.204 0 CA-C-O 121.491 0.662 . . . . 0.0 110.869 -179.623 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.444 ' O ' ' HG2' ' A' ' 58' ' ' ARG . 25.5 mtt180 -149.65 -46.77 0.13 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.86 -179.996 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.699 ' HB3' ' HB1' ' A' ' 54' ' ' ALA . 0.3 OUTLIER 33.8 53.92 0.51 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.908 179.916 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.91 179.913 . . . . . . . . 0 0 . 1 stop_ save_