data_6jxv_residue ############################ # Computer software used # ############################ 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 6jxv _Structure_validation_residue.Date_analyzed 2020-01-31 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 ' 21' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 . . . . . 0 N--CA 1.479 1.0 0 CA-C-O 120.714 0.292 . . . . 10.0 110.517 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 32.4 mm -105.81 126.62 61.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.124 -0.489 . . . . 10.0 109.774 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.42 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.4 ttpm? -99.56 97.74 8.69 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.088 0.471 . . . . 10.0 110.546 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 69.5 mt -84.77 144.84 28.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.334 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.5 mtpt -102.53 107.78 18.86 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.932 0.396 . . . . 10.0 110.696 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.0 t -91.05 122.07 42.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 109.078 -0.712 . . . . 10.0 109.078 178.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 39.1 mm -91.15 108.59 20.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 120.933 0.397 . . . . 10.0 111.158 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.97 158.03 49.28 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.767 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -63.71 -22.09 66.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.63 0.252 . . . . 10.0 111.556 -178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -103.41 28.63 6.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.794 0.33 . . . . 10.0 111.42 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.7 m 65.69 27.53 11.29 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.693 -0.685 . . . . 10.0 112.243 178.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.29 125.8 35.25 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.558 -0.534 . . . . 10.0 109.558 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -97.5 102.54 14.33 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.19 0.519 . . . . 10.0 110.627 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.9 mm -89.67 129.83 39.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.522 -179.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.2 m170 -103.7 94.82 5.65 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -91.09 116.02 28.48 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.371 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -86.56 99.65 11.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.179 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.4 m -104.06 171.48 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.936 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 49.5 tttm -127.41 140.02 52.44 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.491 ' SD ' ' HB2' ' A' ' 77' ' ' PRO . 43.9 tpp -75.55 63.68 1.55 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.226 0.536 . . . . 10.0 110.609 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.9 m -161.42 -40.14 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.676 -0.693 . . . . 10.0 109.663 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.2 163.36 27.14 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.32 -0.854 . . . . 10.0 111.983 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -90.47 153.62 20.25 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.182 -0.917 . . . . 10.0 109.768 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.5 mt -72.72 -10.6 59.99 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.163 -0.215 . . . . 10.0 111.146 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 30.8 tptt -60.36 -47.31 86.63 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.281 -0.637 . . . . 10.0 109.281 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -62.92 -37.2 86.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.144 -0.935 . . . . 10.0 110.486 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -69.14 -45.31 70.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.319 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -60.01 -47.15 87.02 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.222 -0.445 . . . . 10.0 112.063 -179.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -69.27 -37.69 78.02 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 121.051 -0.259 . . . . 10.0 111.584 -178.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.438 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 45.8 m -66.09 -35.65 81.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.852 0.358 . . . . 10.0 111.391 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -66.65 -35.49 80.29 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.484 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 64.5 m -63.86 -35.24 79.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.953 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.438 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 64.2 mt-30 -71.02 -33.71 70.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.178 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.64 -32.99 74.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.599 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -92.15 -29.29 16.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.264 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 97.1 33.08 6.14 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 120.741 -0.742 . . . . 10.0 112.442 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.8 m -128.39 156.96 76.09 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 110.262 -0.273 . . . . 10.0 110.262 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -68.87 156.54 65.08 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.125 1.884 . . . . 10.0 111.197 179.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.484 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 12.1 ttt -67.02 156.43 36.05 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.962 -0.295 . . . . 10.0 110.38 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.4 t30 79.78 -0.27 2.14 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 123.932 0.77 . . . . 10.0 111.697 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 76.0 p -85.89 -27.84 24.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.141 0.496 . . . . 10.0 110.089 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 63.1 mt -112.31 129.83 56.16 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.744 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.468 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.6 ptt-85 -100.86 129.97 46.81 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.798 179.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -96.82 117.86 32.0 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.5 mt -103.66 124.55 49.04 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.336 0.588 . . . . 10.0 111.128 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -127.51 105.38 8.46 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.186 -0.915 . . . . 10.0 109.227 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 65.54 25.13 11.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.459 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.98 -11.37 65.98 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.927 -0.654 . . . . 10.0 112.958 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -101.4 148.62 24.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.782 0.291 . . . . 10.0 110.285 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.401 HH12 ' HD2' ' A' ' 70' ' ' ARG . 9.6 ptm180 -89.3 131.43 35.4 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.99 0.424 . . . . 10.0 110.376 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 45.7 mm -69.89 120.91 18.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.217 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.404 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -85.19 169.19 14.08 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.326 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -72.62 -30.75 64.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.905 0.383 . . . . 10.0 111.237 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 18.1 p-10 -91.23 9.38 31.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.877 0.37 . . . . 10.0 111.146 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 72' ' ' ALA . 1.4 m170 -74.94 148.97 39.56 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.107 0.48 . . . . 10.0 110.765 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.593 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -133.59 145.42 56.22 Favored Pre-proline 0 C--N 1.32 -0.689 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.082 179.33 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . 0.491 ' HB2' ' SD ' ' A' ' 40' ' ' MET . 31.6 Cg_exo -59.04 -13.27 18.3 Favored 'Trans proline' 0 N--CA 1.477 0.522 0 C-N-CA 122.834 2.356 . . . . 10.0 112.991 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -73.7 -27.57 61.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.558 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.593 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.0 pt-20 -98.65 172.45 7.47 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.694 -0.484 . . . . 10.0 109.694 179.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 31.5 mt 72.26 -55.9 0.66 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.685 0.616 . . . . 10.0 110.989 -179.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 121.27 66.42 0.25 Allowed Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 121.076 -0.583 . . . . 10.0 112.377 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 60.6 mtt -96.78 137.4 35.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.555 0.217 . . . . 10.0 110.497 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.465 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 2.4 mm-40 -138.04 -173.04 3.4 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.042 0.449 . . . . 10.0 111.307 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.42 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 24.6 tp10 -73.67 140.58 46.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.001 -0.545 . . . . 10.0 109.909 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 68.25 23.59 7.75 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.604 0.565 . . . . 10.0 110.682 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.5 t0 -72.18 152.53 42.2 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.071 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 41.3 t -107.19 122.66 61.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.439 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.9 tt -126.27 134.34 66.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -103.34 145.92 29.24 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.771 0.32 . . . . 10.0 111.312 -178.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -126.99 125.31 66.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.115 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -130.19 157.31 42.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.608 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -82.97 131.74 35.17 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.101 -0.333 . . . . 10.0 110.101 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.468 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.2 mm-40 -78.92 154.54 29.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.66 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -70.51 -14.83 62.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.96 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.5 p -74.43 -25.42 59.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.759 179.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.84 -9.59 44.02 Favored Glycine 0 C--N 1.332 0.328 0 CA-C-N 115.919 -0.582 . . . . 10.0 112.107 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.799 -1.001 . . . . 10.0 110.928 -179.339 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 7.0 t30 . . . . . 0 N--CA 1.483 1.203 0 CA-C-O 121.07 0.462 . . . . 10.0 110.62 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 57.2 t-20 -118.08 124.71 48.74 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 109.052 -0.722 . . . . 10.0 109.052 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -122.98 128.26 49.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.225 0.536 . . . . 10.0 111.554 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . 0.427 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 18.5 t0 -122.19 130.2 24.8 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 108.376 -0.972 . . . . 10.0 108.376 178.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 59.9 Cg_endo -109.13 127.56 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.115 0 C-N-CA 121.275 1.317 . . . . 10.0 113.904 -179.128 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 2.0 mt -119.96 136.89 55.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 113.815 -1.539 . . . . 10.0 109.192 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 3.1 t -113.95 135.79 52.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-O 121.659 0.742 . . . . 10.0 109.861 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 3.6 tp . . . . . 0 C--N 1.314 -0.936 0 CA-C-N 114.248 -1.342 . . . . 10.0 111.326 -176.874 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 . . . . . 0 N--CA 1.483 1.219 0 CA-C-O 120.468 0.175 . . . . 10.0 110.588 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 38.1 mm -114.1 116.0 51.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.425 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.2 ttpm? -99.95 106.53 18.34 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.986 0.422 . . . . 10.0 110.451 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 31.2 mt -90.99 150.92 21.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.648 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.5 mtpt -107.16 109.68 21.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.283 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.41 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.4 t -92.6 126.59 45.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 179.223 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 27.3 mm -94.8 112.22 26.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.978 0.418 . . . . 10.0 110.992 -179.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.25 160.66 35.03 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.776 -0.647 . . . . 10.0 112.028 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.9 tp60 -63.08 -32.82 74.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.044 0.387 . . . . 10.0 112.044 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -88.9 25.66 1.74 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.777 0.322 . . . . 10.0 111.52 -179.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.6 m 65.66 42.58 3.56 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.251 0.548 . . . . 10.0 111.13 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.6 p -101.82 135.11 43.92 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.276 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -108.49 96.39 6.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.272 0.558 . . . . 10.0 109.495 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.41 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 7.2 mm -79.99 129.67 37.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.682 -0.69 . . . . 10.0 111.261 -178.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -101.32 86.23 2.95 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.624 -0.717 . . . . 10.0 109.654 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.27 117.77 30.47 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.506 -0.478 . . . . 10.0 110.167 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -93.22 104.11 16.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.401 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.4 m -103.54 170.49 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.341 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -123.12 135.72 54.49 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.272 -0.27 . . . . 10.0 110.272 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.53 ' O ' ' HB ' ' A' ' 41' ' ' THR . 62.3 tpp -74.13 76.24 1.76 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.437 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.53 ' HB ' ' O ' ' A' ' 40' ' ' MET . 12.0 t 170.39 -24.86 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.334 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.79 151.95 24.0 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.188 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -74.03 144.27 45.17 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.762 -0.653 . . . . 10.0 110.099 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 58.7 mt -75.0 -4.19 36.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.003 0.43 . . . . 10.0 110.616 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.3 tptt -58.17 -50.86 72.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.627 -0.715 . . . . 10.0 109.549 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -63.21 -39.14 93.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.765 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -62.29 -43.37 98.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.072 -0.513 . . . . 10.0 111.582 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -62.62 -45.39 93.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.29 -0.414 . . . . 10.0 112.082 -179.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -73.52 -35.78 65.63 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.0 -0.28 . . . . 10.0 111.715 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.0 m -64.72 -30.81 71.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.952 0.406 . . . . 10.0 110.807 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -69.14 -36.23 77.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.102 0.477 . . . . 10.0 109.796 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.564 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.3 m -63.5 -37.1 86.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.179 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -63.55 -34.61 78.17 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.399 179.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -69.85 -37.93 76.31 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.573 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -79.88 -18.29 51.04 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.796 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.34 24.62 62.97 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.933 -0.651 . . . . 10.0 112.018 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.4 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 18.3 m -124.93 155.92 69.75 Favored Pre-proline 0 C--N 1.325 -0.46 0 N-CA-C 110.618 -0.142 . . . . 10.0 110.618 -179.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -65.18 154.62 72.62 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.553 2.169 . . . . 10.0 111.993 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.564 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 17.2 ttt -67.5 157.91 33.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.853 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 33.5 t30 79.21 4.16 2.29 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.767 0.827 . . . . 10.0 111.656 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -93.29 -20.61 20.24 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.126 0.489 . . . . 10.0 109.994 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 43.2 mt -116.81 137.81 51.94 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.771 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.486 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 20.1 ptt-85 -107.44 132.04 53.62 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.258 179.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -95.72 115.56 27.6 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.5 mt -105.52 112.5 25.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.065 0.459 . . . . 10.0 110.717 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -117.86 110.63 18.0 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.343 179.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 61.51 28.62 17.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.464 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.18 -21.43 46.05 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.9 -0.667 . . . . 10.0 113.815 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -99.06 150.96 21.47 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 117.269 0.535 . . . . 10.0 111.192 -178.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.429 HH12 ' HD2' ' A' ' 70' ' ' ARG . 11.2 ptm85 -87.09 134.68 33.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.157 0.503 . . . . 10.0 110.565 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.9 mm -75.25 125.48 34.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.998 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.423 ' HB1' ' CD2' ' A' ' 75' ' ' HIS . . . -85.32 168.79 14.36 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.301 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.81 -25.72 59.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.92 0.39 . . . . 10.0 110.872 -179.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -98.08 20.59 12.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.761 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.423 ' CD2' ' HB1' ' A' ' 72' ' ' ALA . 9.5 m170 -88.77 156.97 18.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.729 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.466 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 5.0 p -134.78 154.74 79.58 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.83 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -64.85 -15.01 48.21 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.382 2.055 . . . . 10.0 112.119 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -70.1 -40.37 74.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.817 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.4 pt-20 -85.54 167.9 14.99 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.818 -0.438 . . . . 10.0 109.818 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.1 mt 73.06 -53.04 0.71 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.108 0.563 . . . . 10.0 110.754 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.79 81.41 0.86 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.931 -0.652 . . . . 10.0 112.464 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.2 mtt -109.11 132.0 54.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.685 0.279 . . . . 10.0 110.286 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -128.66 -177.11 4.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.555 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.425 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 21.5 tp10 -74.89 137.03 41.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.446 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 68.89 28.19 5.38 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.675 0.609 . . . . 10.0 111.203 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.82 153.94 30.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.005 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 67.2 t -105.53 132.7 51.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.975 0.416 . . . . 10.0 111.744 -178.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.1 tt -136.95 143.36 35.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.088 -0.708 . . . . 10.0 109.088 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -110.69 149.82 29.92 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.951 0.405 . . . . 10.0 111.472 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.6 p -136.91 132.17 47.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.841 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -139.02 165.32 27.45 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.447 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -80.19 135.97 36.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.232 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.486 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.1 mm-40 -78.49 171.07 15.64 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.861 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -89.17 -5.59 57.61 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.108 0.48 . . . . 10.0 109.855 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.0 p -78.07 -67.76 0.7 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.68 -0.691 . . . . 10.0 111.123 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 130.13 -28.79 3.81 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.001 -0.619 . . . . 10.0 111.93 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.69 -1.061 . . . . 10.0 111.538 179.658 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 42.0 t30 . . . . . 0 N--CA 1.483 1.205 0 CA-C-O 120.962 0.41 . . . . 10.0 110.392 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -122.32 121.38 36.6 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.382 -0.97 . . . . 10.0 108.382 177.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -126.25 128.71 47.62 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.9 0.704 . . . . 10.0 112.9 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . 0.418 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 28.6 t70 -124.18 129.71 24.63 Favored Pre-proline 0 C--N 1.313 -0.989 0 N-CA-C 106.73 -1.581 . . . . 10.0 106.73 175.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 43.6 Cg_endo -109.84 127.92 0.04 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 121.843 1.696 . . . . 10.0 113.959 -178.147 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.9 mt -118.95 135.93 57.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 114.739 -1.119 . . . . 10.0 110.112 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 1.4 t -113.29 135.4 52.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.129 -0.487 . . . . 10.0 109.94 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 6.1 tp . . . . . 0 C--N 1.316 -0.871 0 CA-C-N 114.964 -1.016 . . . . 10.0 110.929 -177.547 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 110.161 -0.311 . . . . 10.0 110.161 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.5 mm -113.86 125.83 71.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.368 -0.378 . . . . 10.0 109.983 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -96.46 105.16 17.2 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.083 0.468 . . . . 10.0 111.213 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 91.3 mt -90.6 140.85 29.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.905 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.2 mtpt -106.53 116.47 31.98 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.933 0.397 . . . . 10.0 111.135 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.469 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.8 t -101.98 123.84 55.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 37.7 mm -97.78 108.52 21.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.063 0.459 . . . . 10.0 110.832 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.29 170.9 54.31 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.678 -0.692 . . . . 10.0 112.014 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -70.63 -19.17 62.84 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.974 0.416 . . . . 10.0 110.898 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -96.38 21.66 8.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.454 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.3 m 61.97 37.47 14.98 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.476 -0.784 . . . . 10.0 111.136 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 p -90.18 138.93 31.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.126 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.471 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 2.0 mt-10 -104.7 94.05 5.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.095 0.474 . . . . 10.0 110.051 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 19.6 mm -80.84 121.64 34.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.027 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -103.01 88.05 3.07 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.518 -0.549 . . . . 10.0 109.518 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -91.01 114.58 27.14 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.405 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.6 ttmt -86.99 97.99 11.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.046 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.0 m -100.72 172.95 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.621 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 tttt -124.55 135.6 53.29 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.82 -0.437 . . . . 10.0 109.82 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 56.8 tpp -74.61 78.64 1.99 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.891 0.377 . . . . 10.0 111.313 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 7.0 t 174.67 -32.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.336 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.22 148.43 33.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.888 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -72.16 148.96 45.13 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.413 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 80.1 mt -71.22 -6.51 40.19 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.997 0.427 . . . . 10.0 110.463 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.469 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 42.7 tptt -57.38 -52.86 63.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.752 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -60.79 -33.82 73.56 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.221 -0.9 . . . . 10.0 111.072 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.63 -44.98 69.54 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.223 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 57.1 mtpt -61.13 -47.01 88.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.982 -178.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 6.5 pt-20 -68.06 -43.07 79.48 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.932 -0.307 . . . . 10.0 111.603 -179.074 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.1 m -62.7 -34.28 76.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.702 0.287 . . . . 10.0 111.199 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -66.6 -38.85 87.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.697 0.284 . . . . 10.0 110.291 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.568 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.5 m -63.47 -41.28 98.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 10.0 109.828 179.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -64.25 -36.61 84.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.328 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.401 HH21 ' CG ' ' B' ' 360' ' ' ASP . 19.8 tpt180 -63.02 -32.08 73.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.847 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -89.63 -31.13 17.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.718 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 106.96 -19.92 34.46 Favored Glycine 0 C--O 1.23 -0.135 0 C-N-CA 121.111 -0.566 . . . . 10.0 112.251 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.0 m -77.29 155.5 81.93 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 110.543 -0.169 . . . . 10.0 110.543 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -62.11 168.03 9.83 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.479 2.12 . . . . 10.0 111.875 179.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.568 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 24.9 ttt -70.46 148.16 48.63 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.785 0.326 . . . . 10.0 111.45 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t30 73.52 6.78 5.09 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.124 -0.944 . . . . 10.0 112.501 178.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.3 p -76.73 -24.85 53.03 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.852 -0.795 . . . . 10.0 108.852 178.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 56.1 mt -115.15 132.24 56.67 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 114.863 -1.062 . . . . 10.0 109.757 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.53 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 13.2 ptt-85 -100.86 129.98 46.8 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.202 -0.453 . . . . 10.0 110.417 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.457 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 64.9 m-85 -91.42 119.1 31.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.018 179.496 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.8 mt -108.98 121.24 44.7 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.539 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -129.96 111.07 12.18 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.652 -0.703 . . . . 10.0 109.627 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 66.57 23.5 10.36 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.214 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.94 -8.23 70.32 Favored Glycine 0 N--CA 1.453 -0.195 0 C-N-CA 121.014 -0.612 . . . . 10.0 113.1 179.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -109.33 144.14 37.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.587 0.232 . . . . 10.0 110.668 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.457 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 11.9 ptm180 -84.01 133.83 34.66 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.173 0.511 . . . . 10.0 110.438 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.1 mm -71.68 125.02 29.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.878 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.02 167.22 19.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.09 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.39 -25.25 59.37 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.162 0.506 . . . . 10.0 110.719 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -96.13 13.74 26.24 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.791 -0.64 . . . . 10.0 111.073 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.9 m170 -85.35 152.52 23.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.149 0.5 . . . . 10.0 111.223 -179.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.501 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 35.4 p -124.43 155.58 68.58 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.95 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -70.94 -10.78 28.27 Favored 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.166 1.911 . . . . 10.0 112.19 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -77.76 -30.1 51.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.386 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.2 pt-20 -92.81 174.69 7.12 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.583 -0.525 . . . . 10.0 109.583 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 4.8 mt 72.89 -56.59 0.66 Allowed 'General case' 0 N--CA 1.469 0.503 0 O-C-N 123.548 0.53 . . . . 10.0 111.017 -179.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 126.16 66.12 0.17 Allowed Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 121.206 -0.521 . . . . 10.0 111.917 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 55.7 mtt -101.85 134.21 45.39 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.738 0.304 . . . . 10.0 110.367 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 0.3 OUTLIER -138.65 178.61 7.02 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.766 -179.848 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.423 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 13.4 tp10 -67.02 143.71 56.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.265 -0.425 . . . . 10.0 109.944 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 22.4 mm-40 70.4 22.24 5.36 Favored 'General case' 0 C--O 1.232 0.169 0 O-C-N 123.716 0.635 . . . . 10.0 111.732 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.454 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.3 OUTLIER -78.89 153.23 30.68 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.352 179.433 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 89.6 t -115.77 128.45 73.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.441 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.9 tt -124.49 144.61 33.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.434 -0.58 . . . . 10.0 109.434 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -105.38 144.84 31.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.849 0.357 . . . . 10.0 110.893 -178.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 9.8 p -135.81 129.86 48.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.987 0.422 . . . . 10.0 110.226 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -135.54 167.69 20.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.508 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -83.18 134.1 34.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.714 0.293 . . . . 10.0 111.145 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.53 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 3.0 mm-40 -74.14 152.42 39.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.396 179.491 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -70.3 -17.16 63.08 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.774 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.2 p -77.08 -25.12 51.97 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.191 0.519 . . . . 10.0 110.639 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.25 -3.81 86.59 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.933 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.822 -0.988 . . . . 10.0 111.295 -179.732 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 65.9 t30 . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 121.014 0.435 . . . . 10.0 110.595 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . 0.444 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 54.1 t30 -121.77 122.24 39.05 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.532 -0.914 . . . . 10.0 108.532 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . 0.471 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 23.2 ptt180 -126.0 128.7 47.87 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 119.791 -0.764 . . . . 10.0 112.035 179.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . 0.401 ' CG ' HH21 ' A' ' 54' ' ' ARG . 28.2 t70 -120.8 130.87 24.65 Favored Pre-proline 0 C--N 1.316 -0.864 0 N-CA-C 106.8 -1.556 . . . . 10.0 106.8 177.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -108.07 128.61 0.05 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.524 0 C-N-CA 121.481 1.454 . . . . 10.0 113.179 -178.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.2 mt -119.27 136.99 54.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 114.128 -1.396 . . . . 10.0 109.734 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 48.7 t -113.25 135.21 53.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.269 0.557 . . . . 10.0 109.59 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 7.1 tp . . . . . 0 C--N 1.317 -0.82 0 CA-C-N 114.854 -1.067 . . . . 10.0 110.594 -177.132 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.5 mm -113.02 124.43 69.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 110.002 -0.37 . . . . 10.0 110.002 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -102.38 112.98 25.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.032 0.444 . . . . 10.0 110.385 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.1 mt -98.07 135.49 39.68 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.307 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -95.34 113.45 25.12 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.671 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.538 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.5 t -96.41 128.42 47.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.745 -0.662 . . . . 10.0 109.584 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.3 mm -101.54 109.49 25.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 120.838 0.352 . . . . 10.0 110.747 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -76.74 174.09 54.27 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 121.027 -0.606 . . . . 10.0 112.626 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 13.8 tp60 -69.92 -29.91 67.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.81 0.338 . . . . 10.0 111.662 -179.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -104.96 40.6 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.062 0.458 . . . . 10.0 111.17 -179.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.7 m 57.9 36.0 25.87 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.692 -0.686 . . . . 10.0 111.328 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.65 94.42 9.85 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.691 -0.686 . . . . 10.0 109.929 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.64 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 20.6 mt-10 -78.64 104.9 9.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.086 0.47 . . . . 10.0 109.784 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.422 HG21 HD13 ' A' ' 34' ' ' ILE . 4.1 mm -95.57 136.79 25.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.28 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 45.9 m-70 -110.97 95.33 5.48 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.512 -0.551 . . . . 10.0 109.512 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.04 121.28 34.22 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.356 -0.383 . . . . 10.0 110.499 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -89.17 107.4 19.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.809 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.4 m -110.27 171.05 3.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.969 0.414 . . . . 10.0 110.94 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 75.4 tttt -122.33 140.56 52.52 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.516 ' O ' ' HB ' ' A' ' 41' ' ' THR . 51.6 tpp -74.94 74.9 2.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.745 0.307 . . . . 10.0 111.449 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 40' ' ' MET . 14.5 t 169.82 -24.91 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.559 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -75.99 149.6 37.58 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.887 0.375 . . . . 10.0 110.934 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 25.4 m170 -78.36 138.31 38.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.003 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.1 mt -65.69 -16.17 63.5 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.528 -0.305 . . . . 10.0 111.46 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.435 ' HD2' ' HB3' ' A' ' 73' ' ' ASP . 34.7 tttp -60.31 -42.9 96.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.012 0.434 . . . . 10.0 109.91 178.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -65.58 -30.72 71.49 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.034 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.409 HD11 ' HA ' ' A' ' 47' ' ' LEU . 4.4 mm? -74.56 -49.13 23.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.626 -0.715 . . . . 10.0 111.094 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -56.61 -46.8 80.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.567 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -65.21 -40.37 94.05 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.282 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 65.9 m -67.41 -34.66 77.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.311 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -63.37 -40.84 98.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.995 0.426 . . . . 10.0 109.869 179.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 39.0 m -62.73 -42.21 99.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.767 179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -64.76 -30.41 71.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.646 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -72.52 -45.15 60.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.033 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -76.56 -14.12 60.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.409 -0.36 . . . . 10.0 111.01 -179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.71 37.17 17.41 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.864 -0.684 . . . . 10.0 112.178 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.6 m -130.42 155.4 81.08 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-O 120.511 0.196 . . . . 10.0 110.547 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -66.22 163.95 29.82 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 122.176 1.917 . . . . 10.0 111.92 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 12.1 tpt -70.62 150.68 45.78 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 110.065 -0.346 . . . . 10.0 110.065 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.0 t30 73.75 5.99 4.9 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.105 0.562 . . . . 10.0 112.166 179.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 80.4 p -84.0 -23.29 31.05 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.145 0.497 . . . . 10.0 110.351 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 43.7 mt -121.21 147.21 45.92 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.428 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.435 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 18.0 ptt-85 -116.9 134.24 55.01 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.243 -0.435 . . . . 10.0 109.963 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.403 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 86.0 m-85 -95.9 128.29 42.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.091 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 90.7 mt -112.23 125.89 54.64 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.229 0.538 . . . . 10.0 111.369 -179.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -137.59 118.51 14.25 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.537 -0.912 . . . . 10.0 108.537 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 66.23 19.6 11.07 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.218 0.532 . . . . 10.0 110.494 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.16 -4.84 84.61 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.221 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -105.39 145.46 30.77 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.189 -0.3 . . . . 10.0 110.189 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.403 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 12.1 ptm180 -85.0 125.76 32.98 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.089 0.471 . . . . 10.0 110.214 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 43.6 mm -63.98 123.58 17.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.313 -0.858 . . . . 10.0 111.52 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.07 166.22 15.19 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.203 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.435 ' HB3' ' HD2' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -73.89 -19.15 60.79 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.995 0.426 . . . . 10.0 111.378 -179.389 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -97.06 17.22 17.53 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.117 -0.492 . . . . 10.0 111.045 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -99.94 153.03 19.5 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.051 0.453 . . . . 10.0 111.129 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.409 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 57.5 p -131.63 162.82 53.9 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 108.961 -0.755 . . . . 10.0 108.961 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -69.99 -5.91 17.47 Favored 'Trans proline' 0 CA--C 1.53 0.317 0 C-N-CA 122.33 2.02 . . . . 10.0 112.16 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.64 -30.38 61.61 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.683 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.472 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 1.4 pt-20 -101.38 171.56 7.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.162 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 7.5 mt 73.26 -49.0 0.69 Allowed 'General case' 0 N--CA 1.469 0.498 0 O-C-N 123.699 0.624 . . . . 10.0 111.285 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 113.53 76.27 0.73 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.83 -0.7 . . . . 10.0 112.443 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 58.1 mtt -105.76 122.46 46.12 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.837 0.351 . . . . 10.0 110.265 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.523 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 5.4 mm-40 -120.97 -178.75 3.82 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.949 -179.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -70.74 144.03 51.06 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 67.04 23.54 9.7 Favored 'General case' 0 N--CA 1.462 0.171 0 O-C-N 123.523 0.514 . . . . 10.0 110.904 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.523 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.8 OUTLIER -75.6 148.51 38.75 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.862 -0.421 . . . . 10.0 109.862 179.788 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 94.8 t -107.13 119.57 56.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.038 0.447 . . . . 10.0 111.446 -178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.538 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 15.6 tt -118.49 136.36 55.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -103.07 150.65 23.39 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.84 0.352 . . . . 10.0 110.975 -178.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.6 p -136.43 131.43 48.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.012 179.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -135.02 159.87 40.14 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.411 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -73.49 136.92 44.2 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.505 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.435 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 1.3 mm-40 -73.5 159.62 32.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.697 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -72.98 -24.79 60.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.191 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.8 p -78.28 -34.27 49.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.214 0.53 . . . . 10.0 110.899 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.31 12.92 77.84 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.925 -0.87 . . . . 10.0 110.925 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.947 0 CA-C-O 118.876 -0.958 . . . . 10.0 111.283 -179.642 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 . . . . . 0 N--CA 1.48 1.025 0 CA-C-O 121.347 0.594 . . . . 10.0 110.168 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . 0.64 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 2.5 m-20 -120.17 125.88 49.3 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 108.454 -0.943 . . . . 10.0 108.454 179.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 22.3 ptt180 -125.84 122.05 35.02 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 119.378 -0.929 . . . . 10.0 113.019 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -128.46 127.27 23.64 Favored Pre-proline 0 C--N 1.316 -0.888 0 N-CA-C 107.536 -1.283 . . . . 10.0 107.536 174.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -110.78 126.34 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.154 0 C-N-CA 121.66 1.573 . . . . 10.0 113.086 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.7 mt -120.27 135.56 60.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.027 -0.988 . . . . 10.0 109.707 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 21.6 t -113.19 135.74 51.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.47 0.652 . . . . 10.0 109.721 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 7.8 tp . . . . . 0 C--N 1.324 -0.522 0 CA-C-N 114.836 -1.075 . . . . 10.0 112.107 -176.135 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 . . . . . 0 N--CA 1.478 0.95 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.1 mm -118.55 113.4 41.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.762 -0.459 . . . . 10.0 109.762 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.51 ' HB3' ' HZ3' ' A' ' 23' ' ' LYS . 2.6 ttpm? -96.7 111.61 23.7 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.236 -0.438 . . . . 10.0 109.9 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 30.1 mt -94.03 150.87 19.95 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.4 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 38.0 mtpt -110.31 107.53 17.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.284 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.443 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 3.2 t -89.08 126.21 42.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.598 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.9 mm -93.54 115.87 33.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 120.984 0.421 . . . . 10.0 111.188 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.59 147.1 19.75 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 111.256 -0.738 . . . . 10.0 111.256 178.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -64.47 -21.14 66.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.778 0.323 . . . . 10.0 111.811 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -95.45 28.21 3.03 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 120.857 0.36 . . . . 10.0 111.021 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.1 m 61.0 66.42 0.9 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.588 0.708 . . . . 10.0 110.919 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.2 p -136.59 144.85 44.34 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.096 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -118.57 103.86 10.12 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.443 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 5.5 mm -88.77 119.74 36.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.197 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -96.93 96.53 8.58 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -97.3 112.86 24.49 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.398 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -86.73 103.13 14.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.977 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -108.31 173.13 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.816 0.341 . . . . 10.0 110.675 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.414 ' HD2' ' CG2' ' A' ' 41' ' ' THR . 23.4 ttmt -121.9 137.79 54.65 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.298 -0.63 . . . . 10.0 109.298 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.432 ' O ' ' HB ' ' A' ' 41' ' ' THR . 61.9 tpp -73.94 78.9 1.65 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.957 0.408 . . . . 10.0 110.598 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.432 ' HB ' ' O ' ' A' ' 40' ' ' MET . 15.3 t 174.09 -26.33 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.444 -0.798 . . . . 10.0 110.081 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.31 151.88 26.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.417 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.405 ' ND1' ' HB3' ' A' ' 45' ' ' LYS . 6.3 p80 -76.87 145.55 38.26 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.097 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.5 mt -71.83 -8.97 57.47 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.588 -0.278 . . . . 10.0 111.285 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.405 ' HB3' ' ND1' ' A' ' 43' ' ' HIS . 47.3 tptt -59.47 -48.2 82.57 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.061 0.458 . . . . 10.0 110.007 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.4 tppp? -62.85 -33.94 76.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.309 -0.859 . . . . 10.0 110.715 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.98 -44.24 63.83 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.286 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -61.63 -42.6 99.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.297 -0.41 . . . . 10.0 111.399 -179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -72.34 -39.83 67.84 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 121.001 -0.28 . . . . 10.0 111.289 -179.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.425 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 66.4 m -63.45 -35.77 81.53 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.75 0.31 . . . . 10.0 111.411 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -64.32 -41.46 96.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.799 0.333 . . . . 10.0 110.177 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 57.2 m -62.3 -38.23 88.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.348 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.425 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.4 mt-30 -65.9 -42.9 89.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.79 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -61.75 -35.67 78.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.417 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -83.22 -16.82 45.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.849 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.31 35.58 42.25 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.094 -0.574 . . . . 10.0 112.535 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.3 m -131.37 155.55 81.34 Favored Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 110.24 -0.282 . . . . 10.0 110.24 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.34 159.57 39.18 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.358 2.039 . . . . 10.0 111.769 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 16.0 ttt -71.01 155.95 40.21 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 121.225 -0.19 . . . . 10.0 110.702 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 32.8 t30 76.65 -7.38 1.85 Allowed 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.542 0.737 . . . . 10.0 111.981 179.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.5 p -75.79 -19.45 58.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.226 0.536 . . . . 10.0 110.276 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.3 mt -116.97 135.27 53.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.253 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.432 ' HD3' ' OE2' ' A' ' 93' ' ' GLU . 7.1 ptt180 -111.34 119.96 40.61 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.145 0.498 . . . . 10.0 110.432 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -88.22 124.92 34.33 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.889 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 34.2 mt -114.5 124.86 52.97 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.044 0.449 . . . . 10.0 110.974 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -135.17 119.88 18.3 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.281 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 64.78 20.57 12.17 Favored 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.433 0.458 . . . . 10.0 111.136 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.71 2.45 81.75 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.912 -0.661 . . . . 10.0 112.302 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -114.76 145.06 42.52 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.749 -0.463 . . . . 10.0 109.749 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -80.98 142.19 33.69 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.975 0.417 . . . . 10.0 109.901 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.2 mm -79.28 121.17 31.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.427 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.7 169.47 18.18 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.505 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -81.71 -18.27 44.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.808 0.337 . . . . 10.0 111.085 -179.06 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -101.86 0.96 36.44 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.781 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 18.4 m170 -71.53 159.13 35.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.936 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.6 p -134.57 160.71 67.42 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.826 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -67.12 -14.66 44.15 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.454 2.103 . . . . 10.0 112.249 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -69.28 -46.41 67.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.527 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -82.79 172.91 12.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.147 -0.478 . . . . 10.0 109.839 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.0 mt 73.45 -46.56 0.64 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.164 0.586 . . . . 10.0 111.047 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 110.9 63.48 0.5 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 121.185 -0.531 . . . . 10.0 112.68 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 43.5 mtt -101.68 128.45 47.99 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.844 0.354 . . . . 10.0 110.711 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 2.8 mm-40 -132.56 -174.39 3.44 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.63 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.4 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 42.5 tp10 -66.28 138.33 57.57 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.183 -179.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 66.27 26.3 10.39 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 123.727 0.642 . . . . 10.0 111.9 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.4 OUTLIER -76.3 141.52 41.59 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.851 -0.426 . . . . 10.0 109.851 179.04 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 59.6 t -96.36 120.26 45.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.504 -178.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 15.3 tt -128.8 138.16 55.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.646 -0.707 . . . . 10.0 109.193 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -112.74 149.7 32.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.97 0.414 . . . . 10.0 111.462 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.4 p -130.96 133.86 62.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.184 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -124.84 168.77 12.79 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.985 -0.552 . . . . 10.0 109.577 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -83.08 138.76 33.57 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.362 -0.607 . . . . 10.0 109.362 178.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.432 ' OE2' ' HD3' ' A' ' 63' ' ' ARG . 2.8 mm-40 -74.67 170.41 15.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.197 0.522 . . . . 10.0 111.139 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -82.87 -28.87 29.75 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.483 -0.78 . . . . 10.0 109.687 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -74.35 -55.15 6.33 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.603 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 104.4 11.87 30.26 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.608 -0.806 . . . . 10.0 112.835 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.794 0 CA-C-O 118.891 -0.949 . . . . 10.0 111.913 179.548 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 121.22 0.534 . . . . 10.0 110.869 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 63.0 t-20 -121.16 124.09 43.88 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.458 -0.571 . . . . 10.0 109.458 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 33.2 ptt180 -123.3 126.08 46.24 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.286 0.565 . . . . 10.0 112.507 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -125.33 128.68 24.68 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 108.263 -1.014 . . . . 10.0 108.263 176.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -111.02 128.0 0.03 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 121.851 1.7 . . . . 10.0 113.52 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . 0.417 HD12 HG21 ' B' ' 362' ' ' ILE . 6.1 mt -120.51 137.26 54.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 114.807 -1.088 . . . . 10.0 109.965 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 37.7 t -112.54 134.57 54.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.309 -0.626 . . . . 10.0 109.309 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 7.6 tp . . . . . 0 C--N 1.318 -0.777 0 CA-C-N 114.809 -1.087 . . . . 10.0 111.514 -176.113 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 N--CA 1.475 0.822 0 CA-C-O 120.782 0.325 . . . . 10.0 110.436 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 18.1 mm -106.3 123.18 60.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.499 -0.556 . . . . 10.0 109.499 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.464 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 4.5 ttpm? -96.47 108.12 20.63 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.183 0.516 . . . . 10.0 110.691 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.8 mt -93.36 137.37 32.73 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.844 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -99.87 106.97 18.86 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.116 0.484 . . . . 10.0 110.819 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.0 t -89.41 130.15 39.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.293 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 41.7 mm -91.01 111.59 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.905 0.383 . . . . 10.0 110.779 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -77.37 157.86 46.8 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.689 -0.687 . . . . 10.0 112.235 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 12.6 tp60 -58.52 -32.24 68.65 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -97.07 29.16 3.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.775 0.321 . . . . 10.0 111.387 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 m 64.52 35.4 9.38 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.351 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.23 136.98 32.72 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.725 -0.67 . . . . 10.0 110.101 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -100.16 101.04 11.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.891 0.376 . . . . 10.0 110.344 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.418 HG22 HD12 ' A' ' 34' ' ' ILE . 0.7 OUTLIER -88.61 120.61 37.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.268 -0.423 . . . . 10.0 109.94 -179.867 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -100.18 98.62 9.3 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -99.98 118.63 36.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.143 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.4 ttmt -91.9 103.49 16.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.241 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 5.0 m -100.2 171.36 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.24 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -121.53 141.73 50.77 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.225 -0.443 . . . . 10.0 109.976 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 57.8 tpp -81.08 73.05 8.13 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.016 0.436 . . . . 10.0 111.032 -179.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.9 t 175.95 -26.16 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.192 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.57 147.36 25.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.254 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 29.8 m80 -75.52 148.8 38.67 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.242 -0.281 . . . . 10.0 110.242 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.7 mt -67.66 -10.53 53.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.813 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.543 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 51.2 tptt -57.77 -43.85 85.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.766 -0.652 . . . . 10.0 109.738 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -67.4 -32.21 72.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.395 -0.821 . . . . 10.0 110.956 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -74.05 -42.92 59.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.542 -178.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -59.76 -48.37 81.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.939 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 20.0 pt-20 -67.7 -37.81 82.77 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.864 0.32 . . . . 10.0 111.864 -178.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.6 m -68.34 -32.6 72.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.695 0.283 . . . . 10.0 111.463 -179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 50.1 t80 -66.87 -39.05 87.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.893 0.377 . . . . 10.0 110.224 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.516 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 81.2 m -62.17 -36.72 82.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.41 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -65.14 -35.96 82.76 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.121 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -64.8 -36.16 83.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.69 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -92.24 -6.92 49.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.394 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 69.58 36.81 77.08 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.917 -0.658 . . . . 10.0 112.43 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.495 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 17.6 m -126.0 155.21 73.59 Favored Pre-proline 0 C--N 1.323 -0.583 0 N-CA-C 110.133 -0.321 . . . . 10.0 110.133 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -68.85 157.85 60.2 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.126 1.884 . . . . 10.0 111.588 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.516 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 9.4 ttt -69.72 154.74 41.56 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.036 -0.265 . . . . 10.0 110.344 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.3 t30 77.35 -3.59 2.43 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 123.939 0.775 . . . . 10.0 111.575 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 87.5 p -83.84 -19.0 35.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.204 0.526 . . . . 10.0 109.71 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 82.6 mt -117.02 126.13 52.41 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.268 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.466 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.8 ptt-85 -100.0 121.86 42.02 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.095 0.474 . . . . 10.0 109.858 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -89.99 111.9 23.13 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.8 mt -99.61 113.3 25.64 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.227 -178.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -113.82 101.61 9.45 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.375 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 60.57 38.37 18.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.026 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.07 -34.0 4.79 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.852 -0.613 . . . . 10.0 113.045 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -83.7 135.04 34.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.716 0.294 . . . . 10.0 110.819 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -83.46 131.81 35.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.979 0.419 . . . . 10.0 110.416 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 48.3 mm -68.27 120.64 16.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.824 -0.625 . . . . 10.0 111.583 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.14 177.67 8.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.278 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.543 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 0.8 OUTLIER -83.86 -14.02 52.22 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.552 -0.294 . . . . 10.0 111.504 -179.074 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.4 p-10 -108.89 9.88 26.57 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.679 -0.237 . . . . 10.0 111.391 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 3.1 m170 -78.56 157.36 28.81 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.957 0.408 . . . . 10.0 111.265 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.527 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.8 OUTLIER -136.54 154.0 76.46 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.64 179.521 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -66.42 -11.0 29.71 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.741 2.294 . . . . 10.0 112.745 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -74.62 -24.34 58.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.32 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.5 pt-20 -107.18 -179.01 3.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.123 -0.49 . . . . 10.0 109.713 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 6.1 mt 71.21 -62.76 0.44 Allowed 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.762 0.664 . . . . 10.0 111.113 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 130.59 59.89 0.1 OUTLIER Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 111.654 -0.578 . . . . 10.0 111.654 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 53.6 mtt -97.38 125.93 42.31 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.75 0.31 . . . . 10.0 110.827 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.6 mm-40 -127.64 -175.39 3.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.878 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.464 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 15.3 tp10 -71.38 138.11 48.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.445 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 64.64 34.34 9.87 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 123.565 0.54 . . . . 10.0 110.723 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.0 OUTLIER -79.53 147.69 32.07 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.24 179.683 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.4 t -103.17 124.64 57.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.987 0.423 . . . . 10.0 111.585 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.4 tt -131.95 147.15 32.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.985 -0.552 . . . . 10.0 109.723 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -107.41 151.55 25.38 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.871 0.367 . . . . 10.0 111.381 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.8 p -135.83 125.83 41.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.887 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -133.18 160.59 36.79 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.73 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.78 133.79 35.14 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.398 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.466 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.9 mm-40 -76.47 150.61 36.65 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.724 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -68.14 -21.68 64.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.939 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.8 p -76.97 -15.05 59.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.949 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.29 5.32 66.42 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 121.105 -0.569 . . . . 10.0 112.296 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.876 0 CA-C-O 118.719 -1.045 . . . . 10.0 111.097 -179.426 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 54.7 t30 . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.655 0.264 . . . . 10.0 111.28 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -122.03 120.03 33.16 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.04 -1.096 . . . . 10.0 108.04 177.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -129.59 129.79 44.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.179 0.514 . . . . 10.0 112.131 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . 0.431 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 27.1 t0 -121.59 128.09 25.78 Favored Pre-proline 0 C--N 1.308 -1.218 0 N-CA-C 107.06 -1.459 . . . . 10.0 107.06 175.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 77.7 Cg_endo -108.86 128.48 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 121.89 1.726 . . . . 10.0 113.695 -178.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.3 mt -120.64 134.6 63.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 114.549 -1.205 . . . . 10.0 110.171 179.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 6.0 t -115.08 135.61 54.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 109.08 -0.711 . . . . 10.0 109.08 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 7.2 tp . . . . . 0 C--N 1.323 -0.544 0 CA-C-N 115.503 -0.771 . . . . 10.0 112.423 -176.503 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 110.063 -0.347 . . . . 10.0 110.063 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.2 mm -111.49 113.23 43.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.325 -0.398 . . . . 10.0 109.962 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.503 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.9 OUTLIER -96.05 109.48 21.89 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.312 0.577 . . . . 10.0 110.282 179.629 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 67.1 mt -95.67 144.01 26.45 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.039 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.5 mtpt -104.43 109.67 21.63 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.896 0.379 . . . . 10.0 110.548 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.409 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.3 t -90.37 128.9 41.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.93 -0.577 . . . . 10.0 109.517 179.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.5 mm -87.98 109.49 19.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.369 -0.378 . . . . 10.0 111.349 -179.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.01 160.29 40.55 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.79 -0.719 . . . . 10.0 111.365 178.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -62.72 -35.84 81.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.89 0.345 . . . . 10.0 111.47 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 17.0 p-10 -88.88 27.94 1.25 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.935 0.397 . . . . 10.0 111.235 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.9 m 61.38 30.54 19.03 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.575 -0.739 . . . . 10.0 111.442 179.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.3 p -82.49 133.31 35.2 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.524 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.529 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 37.0 mt-10 -95.82 96.34 8.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.175 0.512 . . . . 10.0 110.231 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.409 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 2.1 mm -85.68 115.91 27.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.294 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.3 m170 -95.69 96.99 9.37 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.796 -0.446 . . . . 10.0 109.796 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.47 114.46 26.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.641 -179.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -91.25 105.87 18.1 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.195 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.9 m -111.41 170.5 3.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.684 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -117.21 149.31 40.62 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.877 -0.416 . . . . 10.0 109.877 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 60.4 tpp -78.27 69.64 4.51 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.557 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 173.87 -29.85 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.587 179.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.8 137.64 52.01 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.0 m80 -70.84 138.51 50.34 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.093 -0.503 . . . . 10.0 109.889 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.9 mt -66.8 -7.63 22.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.495 -0.32 . . . . 10.0 111.758 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -57.94 -49.63 76.11 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.6 ttpt -70.3 -34.24 72.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.44 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -65.17 -44.65 87.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.86 0.362 . . . . 10.0 110.836 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -60.26 -44.63 95.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.967 -0.56 . . . . 10.0 111.66 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.484 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 17.9 pt-20 -74.53 -34.99 63.13 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.697 -0.401 . . . . 10.0 111.221 -179.403 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.508 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 67.6 m -60.25 -37.36 80.17 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-O 121.072 0.463 . . . . 10.0 110.347 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -64.3 -40.83 96.72 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.562 -0.533 . . . . 10.0 109.562 178.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 56.7 m -63.93 -39.23 93.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.477 -0.783 . . . . 10.0 110.079 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.508 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 60.4 mt-30 -66.06 -36.06 82.2 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.046 179.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.406 HH21 ' CG ' ' B' ' 360' ' ' ASP . 6.4 tpt180 -67.64 -37.77 82.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.672 -0.694 . . . . 10.0 110.774 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -80.79 -29.5 36.09 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.999 0.428 . . . . 10.0 110.797 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 96.26 31.06 7.41 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.831 -0.7 . . . . 10.0 112.242 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.9 m -129.8 155.62 80.18 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 110.182 -0.303 . . . . 10.0 110.182 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -67.25 157.74 60.31 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.375 2.05 . . . . 10.0 111.511 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 10.6 ttt -67.0 156.4 36.1 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.892 -0.323 . . . . 10.0 111.116 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.3 t30 79.06 -8.5 1.63 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.876 0.87 . . . . 10.0 111.953 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 82.8 p -75.75 -23.7 56.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.244 0.545 . . . . 10.0 109.949 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 50.2 mt -116.0 141.33 48.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.482 -0.781 . . . . 10.0 109.981 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.42 HH12 ' HD3' ' A' ' 63' ' ' ARG . 12.7 ptt180 -113.13 129.19 56.59 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.988 0.423 . . . . 10.0 110.11 179.153 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -95.99 124.79 40.14 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.825 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.1 mt -115.29 126.16 54.15 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.159 0.505 . . . . 10.0 110.926 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -124.88 100.35 6.56 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.246 -0.888 . . . . 10.0 109.058 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 64.98 33.82 9.43 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.066 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.24 -14.42 62.38 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 115.725 -0.671 . . . . 10.0 113.24 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -97.02 136.0 38.21 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.833 -0.432 . . . . 10.0 109.833 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -83.86 140.03 32.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.096 0.474 . . . . 10.0 110.66 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 50.0 mm -77.35 118.3 23.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.728 -0.669 . . . . 10.0 111.083 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.57 160.32 21.45 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.51 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -64.84 -25.84 68.08 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.378 -0.374 . . . . 10.0 111.5 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -95.59 7.12 47.18 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.431 -0.35 . . . . 10.0 111.659 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 3.6 m170 -78.3 150.26 33.35 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.221 0.534 . . . . 10.0 111.412 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.574 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -132.34 148.66 70.59 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.578 -0.737 . . . . 10.0 110.101 179.254 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -60.38 -17.23 46.16 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.695 2.263 . . . . 10.0 112.569 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -67.01 -33.89 76.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.778 -0.647 . . . . 10.0 110.474 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.4 pt-20 -96.8 173.77 7.14 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.316 -0.402 . . . . 10.0 109.918 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.412 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 87.6 mt 72.34 -59.15 0.57 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.456 0.703 . . . . 10.0 110.512 -178.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 120.78 87.07 0.95 Allowed Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 121.211 -0.518 . . . . 10.0 111.96 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 62.4 mtt -117.61 132.73 56.46 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.611 0.243 . . . . 10.0 110.415 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -126.67 179.2 5.46 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.817 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.503 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 17.2 tp10 -69.89 137.18 51.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.071 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 5.4 mm-40 71.93 20.38 4.45 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 123.748 0.655 . . . . 10.0 111.591 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.13 147.17 38.73 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.887 -0.325 . . . . 10.0 110.278 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.9 t -99.02 133.71 40.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.88 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.7 tt -134.99 144.13 35.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 178.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -105.92 155.19 19.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.135 0.493 . . . . 10.0 111.997 -178.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.9 p -139.87 127.19 24.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.458 -0.792 . . . . 10.0 109.326 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -133.64 157.89 44.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.606 -0.27 . . . . 10.0 110.391 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -74.6 133.75 42.16 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.14 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.49 ' OE1' ' HA ' ' A' ' 93' ' ' GLU . 3.9 mm-40 -75.69 155.08 36.05 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.754 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -71.78 -24.99 61.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.46 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.2 p -66.92 -39.25 87.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.149 0.499 . . . . 10.0 110.498 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.44 0.9 75.58 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.768 -0.73 . . . . 10.0 112.195 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.825 -0.986 . . . . 10.0 111.295 -179.983 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 121.2 0.524 . . . . 10.0 110.864 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . 0.529 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 52.3 t30 -116.74 124.39 49.51 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 108.904 -0.776 . . . . 10.0 108.904 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 16.5 ptt180 -124.69 128.26 48.55 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.45 0.643 . . . . 10.0 111.277 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . 0.406 ' CG ' HH21 ' A' ' 54' ' ' ARG . 27.8 t0 -120.51 130.37 24.88 Favored Pre-proline 0 C--N 1.314 -0.936 0 N-CA-C 106.631 -1.618 . . . . 10.0 106.631 177.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -108.23 129.26 0.05 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.331 0 C-N-CA 121.728 1.618 . . . . 10.0 113.317 -178.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.8 mt -116.39 131.8 67.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.379 -1.282 . . . . 10.0 109.352 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 25.9 t -114.96 131.55 66.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.675 0.75 . . . . 10.0 109.43 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 7.0 tp . . . . . 0 C--N 1.313 -0.995 0 CA-C-N 114.126 -1.397 . . . . 10.0 110.683 -177.455 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 . . . . . 0 N--CA 1.478 0.933 0 N-CA-C 110.111 -0.329 . . . . 10.0 110.111 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.8 mm -96.08 113.78 31.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 109.78 -0.452 . . . . 10.0 109.78 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.524 ' HB3' ' HZ3' ' A' ' 23' ' ' LYS . 6.2 ttpm? -98.2 115.22 27.89 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.737 0.303 . . . . 10.0 110.497 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 31.1 mt -100.92 145.51 28.55 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.526 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.418 ' HG2' ' CD2' ' A' ' 35' ' ' HIS . 42.0 mtpt -106.58 102.77 12.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.475 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.9 t -87.37 130.67 36.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 109.541 -0.54 . . . . 10.0 109.541 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.8 mm -102.41 114.61 42.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.893 0.378 . . . . 10.0 110.438 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.17 175.38 54.65 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.801 -0.636 . . . . 10.0 112.705 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.7 tp60 -61.42 -29.5 69.98 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 122.57 0.348 . . . . 10.0 111.66 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -97.64 18.97 14.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.817 0.342 . . . . 10.0 110.581 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.3 m 70.37 24.36 4.71 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.469 -0.787 . . . . 10.0 111.893 179.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 p -72.25 137.38 46.76 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.835 -0.432 . . . . 10.0 109.835 179.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.479 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 16.7 mt-10 -100.4 107.08 18.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.182 0.515 . . . . 10.0 110.296 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.6 mm -97.38 118.93 44.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.384 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.418 ' CD2' ' HG2' ' A' ' 25' ' ' LYS . 41.9 m80 -96.35 96.21 8.59 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.994 0.426 . . . . 10.0 110.061 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.4 116.18 28.44 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.311 -0.404 . . . . 10.0 109.939 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -87.32 103.37 15.41 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.09 -0.505 . . . . 10.0 109.859 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 m -108.76 169.88 3.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.043 0.449 . . . . 10.0 111.743 -178.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -117.79 143.41 46.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.096 -0.502 . . . . 10.0 109.836 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 54.3 tpp -78.23 65.26 3.54 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.372 0.606 . . . . 10.0 110.199 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 78.6 m -164.04 -46.81 0.03 OUTLIER 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.617 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.29 147.17 52.56 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.427 -0.806 . . . . 10.0 111.611 -179.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 43.6 m80 -75.31 151.89 38.24 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.659 -0.496 . . . . 10.0 109.659 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.7 mt -70.95 -10.74 60.23 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.455 -0.339 . . . . 10.0 111.492 -179.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.583 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 41.8 tttp -63.06 -47.91 80.95 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.978 -0.379 . . . . 10.0 109.978 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -56.28 -40.61 74.54 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.948 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.03 -40.67 96.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.781 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -66.75 -47.25 72.84 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.923 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -69.81 -36.11 75.36 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.045 0.387 . . . . 10.0 112.045 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 49.4 m -75.59 -29.98 59.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.628 0.251 . . . . 10.0 111.397 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -65.14 -36.38 84.08 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.966 0.412 . . . . 10.0 110.512 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 63.2 m -60.02 -31.69 70.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.673 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -69.96 -31.25 68.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.901 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -67.76 -37.19 81.78 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.679 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -89.27 -14.32 36.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.352 -0.386 . . . . 10.0 111.269 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.94 36.14 29.16 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.896 -0.669 . . . . 10.0 112.392 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.1 m -123.71 159.78 54.21 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 110.561 -0.163 . . . . 10.0 110.561 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -68.27 167.22 22.73 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.221 1.947 . . . . 10.0 111.733 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.46 140.23 57.08 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.209 -179.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.8 t30 69.83 22.17 6.08 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.251 -0.886 . . . . 10.0 112.632 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.9 p -87.82 -23.17 24.11 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.44 0.638 . . . . 10.0 109.358 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 37.2 mt -117.69 134.98 54.33 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.372 -0.831 . . . . 10.0 109.786 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.426 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.2 ptt-85 -104.03 127.27 51.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.121 0.486 . . . . 10.0 110.393 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.449 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 87.4 m-85 -90.13 123.71 34.2 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.475 -0.784 . . . . 10.0 109.983 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.3 mt -110.51 118.35 36.01 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.106 0.479 . . . . 10.0 111.019 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -125.61 116.28 21.47 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.353 -0.84 . . . . 10.0 108.793 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 64.9 25.3 12.78 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.125 0.488 . . . . 10.0 110.737 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.19 -9.63 76.18 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.722 -0.672 . . . . 10.0 112.909 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -107.14 145.27 32.73 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 122.649 -0.324 . . . . 10.0 110.389 -179.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.449 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 14.2 ptm180 -82.5 137.03 34.74 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.234 0.54 . . . . 10.0 110.706 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.2 mm -71.64 119.92 18.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.848 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -74.32 164.22 26.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.427 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.583 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 0.1 OUTLIER -78.34 -1.8 35.04 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.985 0.421 . . . . 10.0 111.501 -179.016 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -121.87 16.1 10.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.254 0.55 . . . . 10.0 110.301 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -84.13 148.11 26.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.238 -179.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.537 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.3 OUTLIER -119.24 145.31 38.12 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.516 -0.765 . . . . 10.0 109.465 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -60.42 -16.07 39.58 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.415 2.076 . . . . 10.0 112.574 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -69.35 -42.86 74.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.741 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 76' ' ' THR . 8.8 pt-20 -84.25 177.26 8.26 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.434 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 11.0 mt 72.94 -54.62 0.69 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.1 0.56 . . . . 10.0 110.773 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 119.2 64.13 0.28 Allowed Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.976 -0.63 . . . . 10.0 112.652 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 47.9 mtt -97.79 135.04 40.13 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.828 0.347 . . . . 10.0 110.586 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.411 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 4.9 mm-40 -133.19 -176.29 4.08 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.2 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 38.8 tp10 -71.09 139.71 50.44 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.663 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 65.65 25.42 11.58 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.209 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -72.27 156.74 38.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.44 -0.345 . . . . 10.0 110.242 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.5 t -111.45 130.94 64.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.894 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.0 tt -137.15 142.31 37.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -102.35 150.69 23.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.89 0.376 . . . . 10.0 111.451 -178.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -131.61 124.61 54.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.877 -0.602 . . . . 10.0 109.533 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -127.36 158.16 38.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.425 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -87.63 130.92 34.61 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.865 0.364 . . . . 10.0 111.636 -178.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.426 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 6.4 mm-40 -71.9 143.5 49.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.879 -0.601 . . . . 10.0 109.97 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -68.32 -25.69 65.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.059 -0.519 . . . . 10.0 111.493 -179.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 32.5 p -71.88 -28.47 63.54 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.937 0.398 . . . . 10.0 110.967 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 80.61 10.4 85.27 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.937 -0.649 . . . . 10.0 111.98 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.949 0 CA-C-O 118.84 -0.978 . . . . 10.0 111.322 -179.862 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 55.7 t30 . . . . . 0 N--CA 1.483 1.186 0 CA-C-O 121.134 0.493 . . . . 10.0 110.26 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . 0.479 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 50.1 t30 -120.69 123.76 43.52 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.557 -0.905 . . . . 10.0 108.557 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -125.91 127.08 45.44 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . 0.436 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 20.6 t0 -122.71 128.7 25.3 Favored Pre-proline 0 C--N 1.318 -0.776 0 N-CA-C 107.394 -1.336 . . . . 10.0 107.394 176.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 57.9 Cg_endo -111.14 128.79 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.184 0 C-N-CA 121.728 1.619 . . . . 10.0 113.638 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.2 mt -119.67 136.93 55.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 113.702 -1.59 . . . . 10.0 109.732 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -113.07 135.77 51.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.394 0.616 . . . . 10.0 109.643 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 5.2 tp . . . . . 0 C--N 1.324 -0.53 0 CA-C-N 115.272 -0.876 . . . . 10.0 111.765 -176.366 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 110.126 -0.324 . . . . 10.0 110.126 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.6 mm -102.79 108.98 25.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.421 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -93.87 96.3 9.65 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.207 0.527 . . . . 10.0 110.61 -179.301 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 45.0 mt -82.23 149.83 27.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.614 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -105.82 107.89 19.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.24 -0.437 . . . . 10.0 110.201 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.454 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.8 t -89.3 121.83 39.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.371 -0.603 . . . . 10.0 109.371 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.0 mm -86.83 110.85 20.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.904 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.82 159.77 44.26 Favored Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 120.871 -0.68 . . . . 10.0 111.553 179.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -62.68 -32.23 73.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.737 0.269 . . . . 10.0 111.525 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -91.75 27.65 2.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.883 0.373 . . . . 10.0 111.342 -179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.9 m 62.56 37.95 12.76 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.777 -0.647 . . . . 10.0 111.179 179.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.85 143.53 26.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.855 -0.611 . . . . 10.0 109.916 179.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.447 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 20.9 mt-10 -109.14 97.43 7.04 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.114 0.483 . . . . 10.0 110.654 -179.492 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.454 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 3.0 mm -87.28 127.06 40.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.907 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -103.22 102.6 12.59 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.021 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.19 116.39 30.31 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.7 ttmt -87.44 95.13 9.9 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.76 -0.655 . . . . 10.0 109.611 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.1 m -101.06 163.95 2.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.461 . . . . 10.0 111.516 -178.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -113.83 142.4 46.14 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.869 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 54.3 tpp -80.42 76.8 7.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.999 0.428 . . . . 10.0 111.663 -179.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.3 t 173.68 -35.54 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.883 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.21 132.65 42.37 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.14 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.7 m80 -64.69 155.95 31.85 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.034 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 48.3 mt -74.51 -0.9 19.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.737 0.303 . . . . 10.0 110.687 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.529 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 12.2 tptp -59.62 -57.33 13.42 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -59.15 -35.39 73.42 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.482 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.67 -48.16 75.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.044 -0.525 . . . . 10.0 111.679 -179.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -58.39 -48.46 80.58 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.951 0.352 . . . . 10.0 111.951 -179.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 4.6 pt-20 -70.58 -31.37 68.35 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.015 0.376 . . . . 10.0 112.015 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.0 m -71.95 -36.91 70.01 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.942 -0.303 . . . . 10.0 110.974 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -64.98 -39.34 93.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.852 0.358 . . . . 10.0 110.092 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.41 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 58.6 m -62.1 -36.08 80.64 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 178.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -66.85 -39.12 87.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.348 179.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -63.38 -41.23 98.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.616 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -78.2 -16.42 57.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.817 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.03 31.83 41.81 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.888 -0.672 . . . . 10.0 112.431 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.7 m -128.34 158.06 72.61 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 110.648 -0.13 . . . . 10.0 110.648 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -64.98 161.62 36.02 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.37 2.046 . . . . 10.0 111.311 178.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.41 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 21.6 ttt -72.22 152.25 42.34 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.038 -0.265 . . . . 10.0 111.124 -179.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 11.7 t30 79.13 -3.57 2.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.024 0.93 . . . . 10.0 111.924 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 81.1 p -78.28 -18.23 55.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.255 0.55 . . . . 10.0 109.795 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 56.9 mt -120.84 135.35 55.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.16 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.493 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 10.7 ptt180 -105.38 125.28 50.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.045 0.45 . . . . 10.0 110.323 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -88.28 117.59 27.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.885 179.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.3 mt -107.52 123.6 48.67 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.123 0.487 . . . . 10.0 110.346 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -127.27 98.61 5.34 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.582 -0.735 . . . . 10.0 109.839 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 62.29 49.13 4.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.279 -0.873 . . . . 10.0 111.351 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.02 -50.87 2.51 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.962 -0.637 . . . . 10.0 113.49 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -80.38 163.19 24.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.868 0.366 . . . . 10.0 111.34 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -101.91 152.4 20.96 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.375 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 46.2 mm -82.33 121.26 35.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.96 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -79.56 163.78 24.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.994 -0.548 . . . . 10.0 109.883 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.67 -21.0 61.14 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.837 0.351 . . . . 10.0 111.706 -179.204 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -100.83 5.37 43.43 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.697 -0.228 . . . . 10.0 111.235 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -74.65 149.03 40.15 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.599 -179.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 23.9 p -123.23 157.42 61.22 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.109 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -69.0 -8.06 22.55 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.514 2.143 . . . . 10.0 112.253 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -79.25 -35.97 40.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.773 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.479 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 7.8 pt-20 -92.21 173.03 8.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.037 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.479 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 52.2 mt 73.78 -42.39 0.51 Allowed 'General case' 0 N--CA 1.469 0.519 0 O-C-N 123.692 0.62 . . . . 10.0 110.947 -179.204 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.418 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 105.41 84.95 1.79 Allowed Glycine 0 N--CA 1.444 -0.824 0 C-N-CA 121.174 -0.536 . . . . 10.0 112.362 179.55 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 52.5 mtt -114.88 148.26 38.84 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.847 -0.427 . . . . 10.0 109.847 179.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.438 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.9 mm-40 -146.12 174.67 11.1 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.954 0.406 . . . . 10.0 110.971 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 20.7 tp10 -65.9 135.5 54.86 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.896 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 18.5 mm-40 69.26 25.65 5.58 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 123.574 0.546 . . . . 10.0 111.558 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.438 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.3 t0 -71.92 167.2 20.57 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.824 -0.351 . . . . 10.0 110.091 179.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.0 t -113.9 117.57 55.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 120.912 0.387 . . . . 10.0 111.836 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 16.9 tt -125.72 139.54 51.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.812 -0.631 . . . . 10.0 109.32 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -113.25 146.63 39.03 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.865 0.364 . . . . 10.0 111.1 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.2 p -133.92 130.76 55.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.145 -0.48 . . . . 10.0 109.811 179.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -134.49 166.6 22.5 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.34 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -76.29 141.47 41.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.685 0.278 . . . . 10.0 110.813 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.493 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 1.1 mm-40 -86.41 151.27 23.68 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.368 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -72.61 -22.08 61.01 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.231 0.539 . . . . 10.0 110.262 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -30.79 69.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.585 -0.734 . . . . 10.0 110.843 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 88.08 -9.99 72.58 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.892 -0.67 . . . . 10.0 113.051 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.837 0 CA-C-O 118.492 -1.171 . . . . 10.0 111.633 -179.807 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 121.075 0.464 . . . . 10.0 110.599 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -119.7 122.51 41.64 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.607 -0.437 . . . . 10.0 109.88 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . 0.447 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 14.7 ptt180 -124.94 128.59 48.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.247 0.546 . . . . 10.0 112.309 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . 0.427 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 32.4 t0 -123.41 128.57 25.19 Favored Pre-proline 0 C--N 1.32 -0.708 0 N-CA-C 107.601 -1.259 . . . . 10.0 107.601 177.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 67.3 Cg_endo -107.91 127.61 0.05 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 121.545 1.497 . . . . 10.0 112.868 -179.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . 0.431 HD11 HG22 ' B' ' 362' ' ' ILE . 3.0 mt -117.9 136.96 53.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 114.364 -1.289 . . . . 10.0 110.186 -178.204 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 40.7 t -112.54 135.57 51.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.477 0.656 . . . . 10.0 110.312 -178.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 7.9 tp . . . . . 0 C--N 1.321 -0.633 0 CA-C-N 114.444 -1.253 . . . . 10.0 110.729 -177.237 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.688 0.28 . . . . 10.0 110.357 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.1 mm -100.95 116.84 45.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.617 ' HE2' ' ND1' ' A' ' 35' ' ' HIS . 0.4 OUTLIER -100.43 105.56 17.05 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.119 0.485 . . . . 10.0 110.763 -179.481 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.8 mt -88.57 150.85 22.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.21 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 44.1 mtpt -110.19 119.59 39.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.0 0.429 . . . . 10.0 110.454 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.7 t -102.11 131.35 50.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.712 -0.677 . . . . 10.0 109.44 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.8 mm -101.33 118.31 47.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.899 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.4 155.81 25.36 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.981 -0.628 . . . . 10.0 112.153 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -65.79 -20.73 66.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.008 0.432 . . . . 10.0 111.053 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -89.84 12.59 16.81 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.777 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.9 m 71.22 39.58 0.94 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.533 -0.758 . . . . 10.0 111.578 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 20.7 p -102.84 140.52 37.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.243 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -107.91 99.46 8.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.121 0.486 . . . . 10.0 109.985 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.0 mm -89.04 134.22 29.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.151 -178.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.617 ' ND1' ' HE2' ' A' ' 23' ' ' LYS . 97.5 m-70 -111.44 105.97 14.74 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.603 -0.518 . . . . 10.0 109.603 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -104.02 117.62 34.73 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.875 0.369 . . . . 10.0 110.487 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.9 ttmt -89.58 100.5 13.29 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.119 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 m -103.2 170.18 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.515 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -121.2 142.73 49.62 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 110.079 -0.341 . . . . 10.0 110.079 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.448 ' O ' ' HB ' ' A' ' 41' ' ' THR . 48.7 tpp -74.96 71.39 2.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.442 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.448 ' HB ' ' O ' ' A' ' 40' ' ' MET . 10.1 t 171.86 -29.96 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.278 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.08 139.48 44.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.205 -179.464 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -68.02 137.57 55.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.231 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.418 HD11 ' HB3' ' A' ' 75' ' ' HIS . 63.9 mt -68.08 -9.23 44.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.347 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.0 tptt -58.53 -47.1 85.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.297 0.57 . . . . 10.0 109.471 178.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -65.42 -34.46 78.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.236 -0.893 . . . . 10.0 110.539 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -68.66 -45.32 72.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.822 -0.626 . . . . 10.0 111.173 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -61.56 -45.67 93.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.812 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.434 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 11.1 pt-20 -70.08 -40.27 75.09 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.937 -0.305 . . . . 10.0 111.371 -179.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.3 m -61.91 -34.82 76.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.818 0.342 . . . . 10.0 110.772 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -65.79 -40.73 92.24 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.673 -0.492 . . . . 10.0 109.673 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 57.9 m -63.92 -39.78 94.95 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.255 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.434 ' HG3' ' O ' ' A' ' 49' ' ' GLU . 79.7 mt-30 -65.26 -41.62 94.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.411 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -64.77 -37.45 87.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.938 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -85.75 -3.32 58.87 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.03 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.3 39.65 98.08 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.234 -0.507 . . . . 10.0 112.516 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.3 m -124.14 156.2 66.69 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.46 ' HG2' ' HB3' ' A' ' 61' ' ' SER . 11.0 Cg_endo -58.36 165.41 7.48 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.697 2.264 . . . . 10.0 112.431 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 22.4 ttt -69.1 132.28 46.33 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.617 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.0 t30 66.29 25.5 10.49 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.271 -0.877 . . . . 10.0 111.996 179.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.46 ' HB3' ' HG2' ' A' ' 58' ' ' PRO . 12.6 p -77.32 -22.32 52.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.564 0.697 . . . . 10.0 109.816 178.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.9 mt -117.92 141.59 48.27 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.082 -0.963 . . . . 10.0 110.372 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.439 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 20.5 ptt-85 -104.87 128.7 53.17 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.751 178.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -94.5 123.97 38.24 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.163 -0.472 . . . . 10.0 110.014 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.7 mt -112.26 121.6 45.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.894 -179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -124.15 113.56 18.5 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.365 -0.834 . . . . 10.0 108.866 178.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 63.12 28.75 16.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.253 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 88.0 -4.89 85.47 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 121.088 -0.577 . . . . 10.0 113.126 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -109.33 145.96 35.15 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.948 -0.39 . . . . 10.0 109.948 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -85.86 139.54 31.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.194 0.521 . . . . 10.0 110.795 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.5 mm -74.91 121.5 26.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.881 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -75.29 164.39 26.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.014 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.87 -27.09 60.11 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.698 0.285 . . . . 10.0 111.089 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 -99.99 22.88 10.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.962 0.411 . . . . 10.0 110.562 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.418 ' HB3' HD11 ' A' ' 44' ' ' LEU . 1.5 m170 -85.03 157.05 20.85 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.109 0.481 . . . . 10.0 111.309 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.531 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.2 OUTLIER -134.56 152.3 77.55 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.742 179.108 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -63.11 -13.15 33.67 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.583 2.189 . . . . 10.0 113.013 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.0 tppt? -69.63 -40.98 76.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.441 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 76' ' ' THR . 7.6 pt-20 -85.36 169.01 14.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.095 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 22.8 mt 73.78 -60.06 0.54 Allowed 'General case' 0 N--CA 1.468 0.427 0 O-C-N 123.828 0.705 . . . . 10.0 110.599 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 119.79 76.76 0.49 Allowed Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.936 -0.65 . . . . 10.0 112.177 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 65.1 mtt -104.08 118.04 35.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.726 0.298 . . . . 10.0 110.489 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 17.4 mm-40 -112.51 -177.67 3.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.663 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.477 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 38.6 tp10 -73.85 140.62 45.86 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.224 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 20.3 mm-40 70.49 20.79 5.8 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.638 0.586 . . . . 10.0 111.009 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.446 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.6 OUTLIER -71.98 150.24 44.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.077 179.568 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 40.2 t -109.4 122.28 63.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.079 0.466 . . . . 10.0 111.572 -178.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.8 tt -121.65 142.15 39.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -102.58 145.8 29.09 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.711 0.291 . . . . 10.0 111.353 -178.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.4 p -130.46 125.55 59.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.188 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -133.66 156.57 47.67 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.223 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.67 142.24 38.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.79 0.329 . . . . 10.0 111.219 -179.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.439 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.9 mm-40 -81.18 149.62 29.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.411 179.508 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -66.43 -37.15 84.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.106 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 6.4 p -76.38 -12.27 60.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.498 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 84.94 -10.22 63.54 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.835 -0.698 . . . . 10.0 112.092 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.939 0 N-CA-C 110.922 -0.871 . . . . 10.0 110.922 -179.834 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 . . . . . 0 N--CA 1.479 1.023 0 CA-C-O 121.359 0.599 . . . . 10.0 110.35 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -118.5 126.69 52.55 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 108.179 -1.045 . . . . 10.0 108.179 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -124.86 128.07 48.11 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 113.162 0.801 . . . . 10.0 113.162 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -124.0 127.43 25.39 Favored Pre-proline 0 C--N 1.314 -0.943 0 N-CA-C 107.429 -1.323 . . . . 10.0 107.429 175.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -109.81 127.85 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.22 0 C-N-CA 121.779 1.652 . . . . 10.0 113.021 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.5 mt -118.64 136.01 57.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 114.182 -1.372 . . . . 10.0 110.056 -179.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 13.6 t -113.02 137.2 46.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 108.972 -0.751 . . . . 10.0 108.972 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 6.4 tp . . . . . 0 C--N 1.316 -0.884 0 CA-C-N 114.867 -1.061 . . . . 10.0 111.696 -176.021 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.3 mm -105.48 114.01 43.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.379 -0.6 . . . . 10.0 109.379 179.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.424 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.7 ttpm? -99.62 103.05 14.73 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.029 0.442 . . . . 10.0 110.506 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 21.8 mt -88.2 153.13 21.48 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.716 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.9 mtpt -107.41 111.15 23.33 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.297 -0.41 . . . . 10.0 109.982 179.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.6 t -95.41 125.82 48.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.874 -0.603 . . . . 10.0 109.62 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.1 mm -95.83 118.87 43.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 120.966 0.413 . . . . 10.0 110.63 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.76 164.75 36.03 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.815 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -62.27 -27.96 69.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.651 0.263 . . . . 10.0 111.378 -179.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -91.56 24.4 3.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.451 -0.34 . . . . 10.0 110.808 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.1 m 61.83 38.37 14.77 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.873 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -93.33 145.02 24.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.969 -0.56 . . . . 10.0 109.831 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.509 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 4.3 mt-10 -113.48 98.42 7.07 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.228 0.537 . . . . 10.0 110.337 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.471 HG21 HD13 ' A' ' 34' ' ' ILE . 3.8 mm -87.13 128.13 40.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.723 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.9 m170 -99.13 94.58 6.58 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.633 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.75 113.31 25.35 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.833 0.349 . . . . 10.0 110.21 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -92.68 103.93 16.26 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.418 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 m -104.38 170.15 2.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.871 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -119.0 139.99 50.77 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.435 ' C ' ' HG1' ' A' ' 41' ' ' THR . 56.8 tpp -76.81 62.7 2.08 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.167 0.508 . . . . 10.0 110.379 179.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.435 ' HG1' ' C ' ' A' ' 40' ' ' MET . 14.5 m -163.15 -38.19 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.219 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.85 152.24 28.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.721 -0.672 . . . . 10.0 112.172 -178.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -80.67 152.69 28.32 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.551 -0.749 . . . . 10.0 109.536 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.9 mt -69.66 -6.7 33.24 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.813 0.301 . . . . 10.0 111.813 -179.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.415 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 50.0 tptt -60.15 -51.31 70.14 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.827 -0.434 . . . . 10.0 109.827 178.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.8 tppp? -62.63 -33.51 75.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.539 -0.755 . . . . 10.0 110.651 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.51 -47.13 67.78 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.07 -0.514 . . . . 10.0 111.57 -179.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -61.82 -45.19 94.92 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.07 0.396 . . . . 10.0 112.07 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 9.8 pt-20 -68.78 -35.14 76.68 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.75 0.278 . . . . 10.0 111.75 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 64.6 m -68.68 -33.02 73.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.755 0.312 . . . . 10.0 110.712 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.433 ' CG ' ' HZ ' ' A' ' 64' ' ' PHE . 30.5 t80 -68.54 -42.25 78.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.937 0.398 . . . . 10.0 110.185 179.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 56.0 m -60.91 -41.82 96.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.954 -0.567 . . . . 10.0 110.216 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -67.08 -30.76 70.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.79 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -69.47 -39.71 77.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.651 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -82.26 -15.75 51.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.216 -179.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.07 39.15 10.32 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.653 -0.784 . . . . 10.0 112.387 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.2 m -135.85 153.49 77.19 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 110.08 -0.341 . . . . 10.0 110.08 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -66.29 159.1 51.64 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.232 1.954 . . . . 10.0 111.103 178.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 17.2 ttt -68.03 159.53 30.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.714 0.292 . . . . 10.0 111.252 -179.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.0 t30 79.7 -16.9 0.62 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.163 0.985 . . . . 10.0 111.743 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 81.0 p -68.49 -37.73 80.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.122 0.487 . . . . 10.0 110.026 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 94.1 mt -102.6 125.33 49.29 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.577 -0.738 . . . . 10.0 110.308 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.487 ' HD3' ' OE2' ' A' ' 93' ' ' GLU . 18.2 ptt180 -106.18 124.78 50.12 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.145 0.498 . . . . 10.0 110.417 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.433 ' HZ ' ' CG ' ' A' ' 51' ' ' TYR . 50.7 m-85 -86.51 126.61 34.56 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.483 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 82.5 mt -113.43 127.7 56.2 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.174 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -135.38 115.72 13.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.464 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 62.3 29.36 17.32 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.529 0.518 . . . . 10.0 110.925 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.32 -37.23 3.48 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.967 -0.635 . . . . 10.0 112.885 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -81.02 158.72 25.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.7 0.286 . . . . 10.0 110.621 -179.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.0 ptm180 -96.54 140.66 30.84 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.979 0.419 . . . . 10.0 110.174 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.0 mm -74.15 123.95 30.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.414 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.58 166.9 17.82 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.51 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -81.08 -3.25 51.29 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.933 -178.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.7 p-10 -115.88 4.79 13.93 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.841 0.353 . . . . 10.0 110.624 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 21.5 m170 -78.45 152.57 32.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.398 -179.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.479 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 11.2 p -123.41 153.98 65.75 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.172 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -66.6 -14.28 43.35 Favored 'Trans proline' 0 N--CA 1.472 0.236 0 C-N-CA 122.484 2.123 . . . . 10.0 112.639 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -73.93 -30.65 62.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.538 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 76' ' ' THR . 13.9 pt-20 -98.6 173.49 6.9 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.738 -0.467 . . . . 10.0 109.738 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.404 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 58.4 mt 73.01 -46.96 0.66 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 123.634 0.584 . . . . 10.0 111.235 -179.583 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 112.4 77.03 0.81 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 121.092 -0.575 . . . . 10.0 112.732 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 56.5 mtt -111.67 115.72 29.59 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.748 0.308 . . . . 10.0 110.35 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 25.1 mm-40 -114.35 177.62 4.58 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.069 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 29.1 tp10 -69.7 139.11 53.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.076 179.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . 0.435 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 13.1 mm-40 70.57 11.85 7.32 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 123.483 0.49 . . . . 10.0 111.927 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.444 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.3 OUTLIER -68.8 147.61 51.51 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.97 -0.292 . . . . 10.0 110.309 179.705 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 92.6 t -98.1 126.39 51.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 121.241 0.543 . . . . 10.0 111.59 -178.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.5 tt -126.39 142.9 41.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.53 -0.759 . . . . 10.0 109.136 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -108.18 157.21 18.51 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.101 0.477 . . . . 10.0 111.841 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.4 p -146.85 125.39 4.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.436 178.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -133.98 169.38 17.2 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.387 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -81.58 134.65 35.52 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.848 0.356 . . . . 10.0 110.965 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.487 ' OE2' ' HD3' ' A' ' 63' ' ' ARG . 2.6 mm-40 -69.42 173.91 5.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.565 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -78.44 -31.35 48.01 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.921 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 16.6 p -72.46 -33.32 66.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.568 -0.742 . . . . 10.0 111.321 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.78 6.32 80.03 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 110.96 -0.856 . . . . 10.0 110.96 -178.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.978 0 N-CA-C 110.716 -0.953 . . . . 10.0 110.716 -179.788 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 66.3 t30 . . . . . 0 N--CA 1.483 1.177 0 CA-C-O 121.283 0.563 . . . . 10.0 110.988 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . 0.509 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 5.9 t-20 -120.34 121.09 37.83 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 108.468 -0.938 . . . . 10.0 108.468 178.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . 0.429 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 16.8 ptt180 -128.66 129.57 46.02 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 113.327 0.862 . . . . 10.0 113.327 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -122.54 130.44 24.66 Favored Pre-proline 0 C--N 1.317 -0.823 0 N-CA-C 107.872 -1.159 . . . . 10.0 107.872 176.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -108.36 127.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 121.246 1.297 . . . . 10.0 113.719 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.2 mt -119.26 135.08 60.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 114.407 -1.27 . . . . 10.0 109.93 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 21.0 t -114.49 135.24 54.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 N-CA-C 109.014 -0.735 . . . . 10.0 109.014 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 6.5 tp . . . . . 0 C--N 1.315 -0.893 0 CA-C-N 115.082 -0.963 . . . . 10.0 111.502 -176.962 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 110.382 -0.229 . . . . 10.0 110.382 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.5 mm -110.95 118.87 58.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -100.4 108.71 20.78 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.119 0.485 . . . . 10.0 111.624 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.8 mt -91.46 147.66 22.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.546 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt -105.25 104.58 14.33 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.077 0.465 . . . . 10.0 110.363 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.436 ' O ' HG12 ' A' ' 34' ' ' ILE . 3.6 t -87.77 125.97 41.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.685 -0.689 . . . . 10.0 109.369 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.6 mm -99.44 116.05 41.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 120.888 0.375 . . . . 10.0 110.575 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.84 169.66 42.81 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.719 -0.753 . . . . 10.0 111.93 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -60.02 -33.17 71.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.357 . . . . 10.0 111.486 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.424 ' CG ' ' HG ' ' A' ' 32' ' ' SER . 9.3 p-10 -86.69 23.25 1.72 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.572 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 72.2 m 61.37 32.21 19.13 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.259 0.552 . . . . 10.0 111.066 179.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.424 ' HG ' ' CG ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -85.03 140.1 31.28 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.73 -0.668 . . . . 10.0 109.714 179.303 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.483 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 12.8 mt-10 -107.62 96.47 6.42 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.106 0.479 . . . . 10.0 110.251 -179.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.436 HG12 ' O ' ' A' ' 26' ' ' VAL . 1.2 mm -82.66 127.44 39.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.657 -179.169 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -96.17 87.68 4.6 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.36 106.26 17.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.336 -179.251 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -92.2 104.69 17.03 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.946 0.403 . . . . 10.0 110.701 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 5.1 m -103.45 167.16 2.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.202 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 64.8 tttt -117.31 137.8 52.19 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 110.164 -0.31 . . . . 10.0 110.164 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.416 ' O ' ' HB ' ' A' ' 41' ' ' THR . 57.6 tpp -75.11 76.13 2.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.014 0.435 . . . . 10.0 110.711 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.416 ' HB ' ' O ' ' A' ' 40' ' ' MET . 8.7 t 173.13 -30.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.127 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.67 145.86 28.56 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.406 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -76.43 147.32 38.03 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.189 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.2 mt -69.02 -7.33 34.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.951 0.405 . . . . 10.0 110.657 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 28.2 tptt -56.15 -52.58 63.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.24 178.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -69.9 -32.83 71.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.685 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -63.87 -39.47 94.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.273 -0.421 . . . . 10.0 111.045 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -61.69 -44.27 97.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.67 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -76.03 -28.67 57.81 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 121.017 -0.273 . . . . 10.0 111.368 -179.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.401 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 66.4 m -63.24 -38.7 92.18 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.952 0.406 . . . . 10.0 111.008 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -67.07 -35.33 79.59 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.898 -0.408 . . . . 10.0 109.898 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.465 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.9 m -62.19 -40.57 96.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.736 -0.666 . . . . 10.0 109.895 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.401 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.3 mt-30 -64.21 -41.08 97.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.527 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -66.95 -32.41 73.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.176 -0.466 . . . . 10.0 110.678 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -84.84 -11.85 54.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.129 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.93 32.31 63.69 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.994 -0.622 . . . . 10.0 112.266 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.9 m -131.37 154.59 81.96 Favored Pre-proline 0 C--N 1.324 -0.543 0 N-CA-C 110.54 -0.171 . . . . 10.0 110.54 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -64.27 164.29 23.37 Favored 'Trans proline' 0 CA--C 1.53 0.277 0 C-N-CA 122.449 2.099 . . . . 10.0 111.577 178.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.465 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 11.6 ttt -72.61 157.83 36.82 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 121.236 -0.186 . . . . 10.0 110.934 -179.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.3 t30 75.12 5.35 4.25 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.525 0.73 . . . . 10.0 111.947 178.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 55.6 p -86.69 -26.36 24.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.371 0.605 . . . . 10.0 109.926 179.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 48.7 mt -117.35 143.23 46.18 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.406 -0.815 . . . . 10.0 110.678 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.513 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 14.2 ptt-85 -115.42 127.7 55.54 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.284 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.445 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 25.3 m-85 -90.37 121.72 32.61 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.061 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 55.4 mt -107.94 111.44 23.54 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.128 0.489 . . . . 10.0 110.709 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -121.7 121.84 38.23 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.409 -0.814 . . . . 10.0 109.022 179.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 63.2 19.34 11.61 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.434 0.459 . . . . 10.0 110.962 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.62 -21.86 43.88 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.925 -0.655 . . . . 10.0 112.585 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -98.14 161.23 13.82 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.572 0.225 . . . . 10.0 110.636 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.445 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 13.3 ptm180 -95.46 143.45 26.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.017 0.437 . . . . 10.0 110.698 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.3 mm -77.95 127.36 38.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.646 -0.706 . . . . 10.0 111.803 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.94 166.44 13.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.33 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -73.35 -13.64 61.14 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.659 0.266 . . . . 10.0 111.521 -179.284 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -105.64 10.7 32.84 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.791 0.329 . . . . 10.0 111.229 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.6 m170 -83.65 149.03 26.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.102 0.477 . . . . 10.0 111.124 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.41 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -129.42 148.09 67.82 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.692 178.888 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -64.32 -6.69 12.21 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.718 2.279 . . . . 10.0 112.798 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.9 tppt? -75.15 -27.27 59.65 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.902 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 76' ' ' THR . 3.2 pt-20 -108.69 -174.99 2.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.556 -179.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 41.0 mt 72.17 -58.49 0.59 Allowed 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.894 0.746 . . . . 10.0 110.922 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 129.36 61.16 0.1 Allowed Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 111.693 -0.563 . . . . 10.0 111.693 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 39.8 mtt -98.16 126.22 43.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.935 0.398 . . . . 10.0 110.644 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.487 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -129.84 173.27 10.83 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.364 179.893 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -66.17 138.33 57.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.235 -0.439 . . . . 10.0 109.834 179.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 69.63 25.89 5.13 Favored 'General case' 0 C--O 1.233 0.198 0 O-C-N 123.65 0.594 . . . . 10.0 111.546 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.487 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.6 OUTLIER -74.5 146.33 42.81 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 179.19 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 41.6 t -99.48 126.07 52.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.03 0.443 . . . . 10.0 111.186 -179.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.7 tt -135.36 143.01 38.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.971 -0.559 . . . . 10.0 109.683 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -110.47 153.62 24.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.018 0.437 . . . . 10.0 110.848 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.9 p -132.42 129.61 59.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.624 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -125.32 165.21 18.77 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.474 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -91.03 132.92 35.71 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.293 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.513 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.9 mm-40 -77.17 152.82 34.66 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.85 0.357 . . . . 10.0 110.807 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -77.64 -14.43 59.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.301 0.572 . . . . 10.0 110.024 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.6 p -71.36 -43.73 66.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.53 -0.759 . . . . 10.0 110.706 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 102.9 -16.21 54.62 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.989 -0.625 . . . . 10.0 112.324 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.933 0 CA-C-O 118.897 -0.946 . . . . 10.0 111.337 -179.617 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 . . . . . 0 N--CA 1.484 1.225 0 CA-C-O 121.044 0.45 . . . . 10.0 110.837 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -120.29 123.13 42.4 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.509 -0.923 . . . . 10.0 108.509 178.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . 0.483 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 27.4 ptt180 -126.25 127.86 46.28 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 119.904 -0.718 . . . . 10.0 111.922 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 34.5 t70 -120.87 130.59 24.78 Favored Pre-proline 0 C--N 1.317 -0.819 0 N-CA-C 106.276 -1.749 . . . . 10.0 106.276 177.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 61.2 Cg_endo -108.05 129.22 0.05 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.281 0 C-N-CA 121.589 1.526 . . . . 10.0 114.005 -177.671 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 23.6 mt -119.08 132.09 69.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 CA-C-N 114.32 -1.309 . . . . 10.0 109.971 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 10.5 t -117.28 135.97 55.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 109.495 -0.557 . . . . 10.0 109.495 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 5.4 tp . . . . . 0 C--N 1.312 -1.032 0 CA-C-N 114.93 -1.032 . . . . 10.0 110.945 -177.009 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 . . . . . 0 N--CA 1.482 1.167 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.4 mm -107.6 110.12 30.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.89 0.376 . . . . 10.0 110.089 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.428 ' NZ ' ' HB3' ' A' ' 23' ' ' LYS . 1.7 ttpm? -100.05 100.45 11.33 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.159 0.504 . . . . 10.0 110.513 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 33.3 mt -83.27 152.22 25.25 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.101 -179.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 40.4 mtpt -110.11 108.85 19.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.06 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.1 t -90.39 131.07 38.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.274 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.4 mm -89.98 110.83 22.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.464 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -76.14 152.9 42.57 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.846 -0.615 . . . . 10.0 112.172 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -61.88 -22.51 65.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.834 0.349 . . . . 10.0 111.553 -179.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -97.29 20.82 10.88 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.841 0.353 . . . . 10.0 110.569 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.2 m 67.42 44.94 1.67 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.605 -0.725 . . . . 10.0 111.128 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.8 p -107.3 149.74 27.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.634 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.44 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 10.0 mt-10 -107.5 101.95 11.26 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.6 mm -92.21 125.94 44.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.269 -179.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 23.5 m-70 -102.01 101.96 12.41 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.747 -0.464 . . . . 10.0 109.747 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.73 113.98 26.3 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.458 -179.38 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -85.7 99.51 11.36 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.867 -0.42 . . . . 10.0 109.867 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 m -106.13 168.88 2.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.996 -179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.462 ' HE2' ' OG1' ' A' ' 41' ' ' THR . 79.1 tttt -120.0 143.2 48.18 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.855 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 58.9 tpp -76.74 58.56 1.44 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.347 0.594 . . . . 10.0 110.507 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.462 ' OG1' ' HE2' ' A' ' 39' ' ' LYS . 5.7 m -158.07 -42.11 0.06 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.513 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.3 147.94 37.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.837 -0.619 . . . . 10.0 111.251 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.3 m80 -75.92 151.98 37.2 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 47' ' ' LEU . 12.6 mt -66.33 -12.45 56.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.753 0.311 . . . . 10.0 111.36 -179.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 43.4 tptt -59.12 -44.4 92.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.156 0.503 . . . . 10.0 109.67 178.129 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -64.69 -32.72 74.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.204 -0.907 . . . . 10.0 110.655 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 44' ' ' LEU . 2.5 mm? -74.96 -41.78 58.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.965 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -60.64 -47.71 85.04 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.898 -179.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -67.31 -46.73 72.65 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.946 0.35 . . . . 10.0 111.946 -178.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.7 m -61.09 -36.38 79.51 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.724 0.268 . . . . 10.0 111.724 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -64.65 -45.84 85.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.774 0.321 . . . . 10.0 110.465 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 60.3 m -59.93 -49.23 78.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.659 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -58.37 -39.88 80.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.128 0.489 . . . . 10.0 110.789 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -64.53 -39.58 94.03 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.154 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -80.3 -6.07 57.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.284 -0.416 . . . . 10.0 111.809 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.91 37.95 17.48 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.654 -0.784 . . . . 10.0 112.694 179.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -139.65 150.72 64.22 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 110.028 -0.36 . . . . 10.0 110.028 179.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.06 162.15 34.76 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.163 1.909 . . . . 10.0 111.424 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.486 ' HG3' ' N ' ' A' ' 60' ' ' ASN . 0.9 OUTLIER -62.84 147.83 48.91 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.893 -0.14 . . . . 10.0 110.637 179.431 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.486 ' N ' ' HG3' ' A' ' 59' ' ' MET . 35.7 t30 83.62 6.11 0.73 Allowed 'General case' 0 N--CA 1.475 0.823 0 O-C-N 124.069 0.856 . . . . 10.0 112.012 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 57.6 p -90.1 -33.88 16.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.041 0.448 . . . . 10.0 110.294 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 33.6 mt -115.2 146.46 41.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.675 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.517 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 15.0 ptt-85 -117.02 135.64 53.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.217 179.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -93.98 127.23 39.64 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.169 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.0 mt -109.86 124.15 50.83 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.552 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -138.04 121.69 17.43 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.385 -0.825 . . . . 10.0 109.208 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 61.91 24.97 14.95 Favored 'General case' 0 C--N 1.331 -0.221 0 O-C-N 123.483 0.49 . . . . 10.0 110.989 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.63 2.0 87.2 Favored Glycine 0 CA--C 1.522 0.474 0 C-N-CA 121.115 -0.564 . . . . 10.0 113.07 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -114.19 164.93 13.21 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.945 0.372 . . . . 10.0 110.572 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -100.3 130.26 46.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.015 0.435 . . . . 10.0 110.217 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.9 mm -67.57 124.44 22.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.383 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -85.08 172.76 11.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.304 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 2.6 m-20 -80.88 -15.45 56.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.883 0.373 . . . . 10.0 111.205 -179.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -107.49 30.18 6.5 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.219 0.533 . . . . 10.0 110.577 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 2.6 m170 -104.47 152.62 22.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.972 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.439 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 6.1 p -130.1 153.81 81.17 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.966 178.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -62.88 -13.78 36.85 Favored 'Trans proline' 0 N--CA 1.475 0.414 0 C-N-CA 122.701 2.267 . . . . 10.0 112.865 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -72.35 -34.36 67.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.839 -179.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 76' ' ' THR . 6.0 pt-20 -94.72 174.34 7.16 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.935 -0.395 . . . . 10.0 109.935 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 15.9 mt 73.84 -41.38 0.48 Allowed 'General case' 0 N--CA 1.468 0.431 0 O-C-N 123.684 0.615 . . . . 10.0 111.249 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 107.79 56.32 0.6 Allowed Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.883 -0.675 . . . . 10.0 112.341 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 47.5 mtt -90.5 128.91 36.68 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.5 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.3 mm-40 -126.56 -179.91 5.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.089 0.471 . . . . 10.0 111.635 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -68.07 140.02 56.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.645 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 62.01 23.61 13.94 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.024 -0.535 . . . . 10.0 111.709 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.5 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.7 t0 -70.75 148.88 47.48 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.204 -0.198 . . . . 10.0 110.548 179.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 89.7 t -97.61 114.02 33.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.036 0.446 . . . . 10.0 111.59 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.414 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 18.8 tt -119.61 142.48 34.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -110.83 151.94 27.24 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.029 0.443 . . . . 10.0 111.636 -178.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.2 p -136.25 125.54 38.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.64 179.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -131.8 157.24 44.39 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.409 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -75.97 138.89 41.24 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.904 0.383 . . . . 10.0 110.845 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.517 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.2 mm-40 -81.05 147.84 29.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.714 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -70.72 -15.4 62.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.08 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.31 -16.72 58.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.962 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.12 -47.3 3.55 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.963 -0.637 . . . . 10.0 112.352 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.821 0 N-CA-C 110.612 -0.995 . . . . 10.0 110.612 179.993 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 . . . . . 0 N--CA 1.477 0.9 0 CA-C-O 121.244 0.545 . . . . 10.0 109.912 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . 0.44 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 53.4 t-20 -121.7 123.86 42.87 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.192 -1.04 . . . . 10.0 108.192 179.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -123.12 122.72 39.15 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.414 -0.914 . . . . 10.0 112.811 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . 0.425 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 18.5 t70 -128.82 128.39 23.46 Favored Pre-proline 0 C--N 1.319 -0.755 0 N-CA-C 107.398 -1.334 . . . . 10.0 107.398 174.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 54.0 Cg_endo -111.72 128.44 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.141 0 C-N-CA 121.551 1.501 . . . . 10.0 113.789 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.1 mt -117.48 135.61 57.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.06 -0.973 . . . . 10.0 109.311 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 19.6 t -113.99 133.51 59.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.569 0.699 . . . . 10.0 110.626 -178.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 4.7 tp . . . . . 0 C--N 1.319 -0.727 0 CA-C-N 114.985 -1.007 . . . . 10.0 111.014 -178.35 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 . . . . . 0 N--CA 1.479 1.019 0 N-CA-C 110.246 -0.279 . . . . 10.0 110.246 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.1 mm -118.52 117.41 54.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.552 ' HZ3' ' CD ' ' A' ' 84' ' ' GLU . 0.0 OUTLIER -97.93 108.75 21.52 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.92 0.391 . . . . 10.0 110.855 -179.816 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 66.7 mt -94.26 126.85 39.76 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.966 -0.561 . . . . 10.0 109.909 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 34' ' ' ILE . 33.4 mtpt -96.84 109.7 22.34 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.01 0.433 . . . . 10.0 110.721 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.4 t -91.98 123.71 44.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.63 -0.713 . . . . 10.0 109.665 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.6 mm -94.06 113.22 28.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 120.984 0.421 . . . . 10.0 110.852 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.6 156.3 33.14 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.81 -0.632 . . . . 10.0 112.087 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -70.15 -12.4 61.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.875 0.369 . . . . 10.0 111.362 -179.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -100.69 22.43 11.94 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.35 0.595 . . . . 10.0 110.052 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.2 m 63.71 45.33 4.58 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 114.814 -1.085 . . . . 10.0 111.822 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.2 p -111.58 138.34 48.24 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.206 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.502 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 16.6 mt-10 -108.81 103.94 13.11 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.152 0.501 . . . . 10.0 109.942 179.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.469 ' O ' ' HA ' ' A' ' 25' ' ' LYS . 3.9 mm -91.18 129.91 41.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.443 -179.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.448 ' CD2' ' HB3' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -109.36 101.28 10.28 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.437 -0.347 . . . . 10.0 110.067 -179.696 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.23 115.35 27.3 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.2 -0.296 . . . . 10.0 110.2 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -88.06 100.13 12.7 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.0 m -107.45 174.04 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.996 0.427 . . . . 10.0 111.544 -178.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.3 tttt -123.23 146.7 47.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.817 -0.629 . . . . 10.0 109.493 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.478 ' O ' ' HB ' ' A' ' 41' ' ' THR . 49.0 tpp -77.64 76.02 4.18 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.089 0.471 . . . . 10.0 111.569 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.478 ' HB ' ' O ' ' A' ' 40' ' ' MET . 15.3 t 170.12 -25.83 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.466 -0.788 . . . . 10.0 110.0 178.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.49 134.01 42.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.239 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 31.5 m170 -70.11 143.78 52.27 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.575 -179.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 75.2 mt -69.38 -8.59 47.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 10.0 111.042 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.502 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 37.4 tptt -58.18 -53.99 52.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.527 178.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -61.16 -41.74 97.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.525 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -57.97 -41.79 83.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.609 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -68.67 -31.98 71.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.403 -0.362 . . . . 10.0 111.315 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 39.7 mt-10 -75.32 -51.78 12.39 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.751 0.31 . . . . 10.0 111.306 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.0 m -61.33 -33.77 74.16 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.278 0.473 . . . . 10.0 112.278 -179.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -63.14 -46.06 89.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.706 0.288 . . . . 10.0 110.778 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.494 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 58.8 m -61.95 -37.23 83.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.093 0.473 . . . . 10.0 110.245 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -61.71 -42.84 99.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.764 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 52.9 ttt85 -69.22 -33.41 73.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.375 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -74.78 -16.42 60.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.708 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.88 30.92 45.66 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.911 -0.661 . . . . 10.0 112.84 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.8 m -137.49 154.53 75.27 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 110.205 -0.295 . . . . 10.0 110.205 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.51 154.64 58.02 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.443 2.095 . . . . 10.0 111.829 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.494 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 3.9 ttt -66.54 157.22 32.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.725 -0.216 . . . . 10.0 110.98 -179.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.449 ' N ' ' HG2' ' A' ' 59' ' ' MET . 4.3 t30 78.02 4.17 2.84 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.633 0.773 . . . . 10.0 111.571 179.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.4 p -87.88 -19.98 26.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.076 0.465 . . . . 10.0 109.958 179.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.0 mt -125.77 135.22 51.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.665 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.513 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 29.1 ptt-85 -112.09 138.96 48.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.241 -0.436 . . . . 10.0 109.88 179.202 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -96.19 132.03 42.04 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.9 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.0 mt -115.78 115.69 26.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.005 0.431 . . . . 10.0 111.132 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -128.07 118.57 23.71 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.563 -0.744 . . . . 10.0 109.357 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 61.66 29.97 18.35 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.079 0.466 . . . . 10.0 110.752 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.89 -4.28 75.84 Favored Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.862 -0.608 . . . . 10.0 112.604 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 44.8 mm-40 -102.34 136.79 41.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.576 0.226 . . . . 10.0 110.717 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -82.3 128.71 34.47 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.621 -0.511 . . . . 10.0 109.621 178.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 46.6 mm -70.03 118.84 15.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.229 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -90.11 168.78 11.7 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.295 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.91 -24.83 62.54 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.202 0.525 . . . . 10.0 110.579 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -95.77 24.97 4.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.423 -0.808 . . . . 10.0 111.58 -179.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 50.1 m170 -109.32 157.47 18.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.79 0.328 . . . . 10.0 110.837 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.567 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 27.9 p -134.26 160.31 68.97 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.067 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -68.73 -14.22 38.7 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.364 2.042 . . . . 10.0 112.012 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -69.65 -34.11 73.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.882 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.567 ' HG2' ' O ' ' A' ' 76' ' ' THR . 6.3 pt-20 -91.22 168.8 11.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.063 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 17.8 mt 73.01 -48.81 0.69 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.405 0.682 . . . . 10.0 111.432 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.14 58.89 0.33 Allowed Glycine 0 N--CA 1.444 -0.77 0 C-N-CA 120.652 -0.785 . . . . 10.0 112.558 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 43.6 mtt -86.34 120.21 27.44 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 179.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -113.17 178.14 4.38 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.204 0.525 . . . . 10.0 111.534 -178.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.552 ' CD ' ' HZ3' ' A' ' 23' ' ' LYS . 3.6 tp10 -69.01 140.52 54.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.413 -0.812 . . . . 10.0 110.762 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 63.6 mm-40 60.59 32.84 20.46 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.792 -0.64 . . . . 10.0 111.582 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -80.61 146.44 31.2 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.663 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 20.2 t -98.11 132.1 43.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.763 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 20.3 tt -135.42 149.34 28.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.018 179.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -108.95 152.49 24.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.982 0.42 . . . . 10.0 111.382 -179.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.8 p -135.22 135.86 51.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.469 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -137.37 157.22 47.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.716 -0.22 . . . . 10.0 110.791 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -80.61 131.36 35.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.581 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.513 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.6 mm-40 -69.47 145.28 52.86 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.879 -179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -63.21 -23.13 67.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.07 -0.514 . . . . 10.0 111.441 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.0 p -76.74 -20.39 56.57 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.908 0.385 . . . . 10.0 111.219 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.67 -11.18 62.42 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.005 -0.617 . . . . 10.0 111.948 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.786 -1.008 . . . . 10.0 111.275 -179.808 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 55.9 t30 . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.775 0.322 . . . . 10.0 110.77 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . 0.502 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 59.7 t30 -120.24 124.38 45.53 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 109.364 -0.606 . . . . 10.0 109.364 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 24.5 ptt180 -124.2 128.24 48.92 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.42 0.629 . . . . 10.0 111.321 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -120.66 130.33 24.9 Favored Pre-proline 0 C--N 1.318 -0.791 0 N-CA-C 107.569 -1.271 . . . . 10.0 107.569 177.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -108.79 130.59 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.232 0 C-N-CA 121.948 1.765 . . . . 10.0 113.456 -178.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 2.6 mt -117.67 136.44 54.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 113.967 -1.47 . . . . 10.0 109.705 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 60.3 t -113.42 133.01 60.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 N-CA-C 109.109 -0.7 . . . . 10.0 109.109 -179.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 6.3 tp . . . . . 0 C--N 1.319 -0.752 0 CA-C-N 114.628 -1.169 . . . . 10.0 110.948 -176.963 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 . . . . . 0 N--CA 1.477 0.881 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 11.6 mm -112.79 123.28 68.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.432 -0.581 . . . . 10.0 109.432 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.492 ' HB3' ' HZ3' ' A' ' 23' ' ' LYS . 6.7 ttpm? -100.18 113.7 26.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.953 0.406 . . . . 10.0 111.207 -179.298 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 80.3 mt -101.26 140.07 36.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.803 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.0 mtpt -101.77 110.44 22.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.758 0.313 . . . . 10.0 110.766 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.435 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 7.1 t -88.1 123.48 40.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 108.915 -0.772 . . . . 10.0 108.915 178.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.8 mm -92.82 111.95 25.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 120.956 0.408 . . . . 10.0 111.473 -178.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.26 156.8 29.85 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 111.314 -0.715 . . . . 10.0 111.314 178.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 48.2 tp60 -64.88 -22.18 66.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.886 0.374 . . . . 10.0 110.992 -179.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.428 ' CG ' ' HG ' ' A' ' 32' ' ' SER . 4.4 p30 -93.98 17.52 12.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.962 0.41 . . . . 10.0 110.819 179.53 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.2 m 62.98 45.8 5.16 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.721 -0.672 . . . . 10.0 111.415 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.428 ' HG ' ' CG ' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -92.3 128.74 38.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.959 179.2 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.441 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 3.6 mp0 -92.34 88.06 6.28 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.513 0.673 . . . . 10.0 110.255 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.435 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 12.7 mm -80.97 128.63 38.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.617 -0.72 . . . . 10.0 111.929 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -103.7 89.82 3.46 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.143 -0.688 . . . . 10.0 109.143 178.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -92.61 109.54 20.96 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.774 -0.371 . . . . 10.0 110.86 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -88.48 97.28 10.99 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.4 m -98.34 168.15 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.885 -179.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 54.1 tttt -118.43 135.33 54.42 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.261 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 45.3 tpp -80.26 77.46 7.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.088 0.471 . . . . 10.0 110.885 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.8 t 177.95 -37.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.222 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.7 148.79 28.8 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.142 179.436 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 13.5 m80 -68.9 153.46 43.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.597 0.237 . . . . 10.0 110.743 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 34.7 mt -69.31 -15.86 63.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.506 -0.315 . . . . 10.0 111.136 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 36.2 tttp -59.25 -46.67 87.88 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.928 -0.397 . . . . 10.0 109.928 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.492 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.5 tppp? -58.7 -32.04 68.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.559 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -74.62 -39.33 62.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.626 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -62.86 -52.5 62.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.899 -0.592 . . . . 10.0 111.789 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -64.4 -31.74 73.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.582 -0.281 . . . . 10.0 111.461 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 53.9 m -72.92 -34.95 66.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.754 0.311 . . . . 10.0 110.918 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -65.98 -36.06 82.29 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.933 0.397 . . . . 10.0 110.14 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 56.6 m -61.95 -40.27 94.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.947 -0.569 . . . . 10.0 109.782 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -66.45 -31.94 73.0 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.54 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.45 HH21 ' CG ' ' B' ' 360' ' ' ASP . 16.9 tpt180 -68.48 -39.74 81.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.871 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -85.51 -16.71 38.65 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.476 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.63 37.93 13.02 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.817 -0.706 . . . . 10.0 112.398 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 9.1 m -133.61 155.41 80.57 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 110.224 -0.288 . . . . 10.0 110.224 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -70.03 167.69 24.07 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.251 1.967 . . . . 10.0 111.373 179.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.7 ttt -74.19 163.52 27.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.608 0.242 . . . . 10.0 110.572 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.2 t30 74.74 0.58 3.6 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.367 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.3 p -86.56 -46.87 9.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.124 0.488 . . . . 10.0 110.036 179.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.2 mt -99.55 131.02 45.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.866 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.514 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 13.2 ptt180 -110.3 128.71 55.67 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.79 179.148 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -88.5 130.27 35.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.937 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.7 mt -113.81 126.22 54.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.067 0.46 . . . . 10.0 110.397 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -135.62 117.32 15.01 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.624 -0.716 . . . . 10.0 109.926 -179.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 62.74 18.51 10.71 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.761 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.91 -18.73 49.0 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.604 -0.808 . . . . 10.0 112.911 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -98.31 157.77 15.98 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.621 -0.34 . . . . 10.0 110.639 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -96.2 131.26 42.85 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.339 -0.391 . . . . 10.0 110.308 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 48.8 mm -66.68 121.03 15.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.609 -0.723 . . . . 10.0 111.556 -179.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.95 168.26 13.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.57 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.463 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -75.67 -18.5 59.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.217 0.532 . . . . 10.0 110.479 179.759 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -96.29 11.44 34.59 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.946 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -90.01 145.7 24.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.235 0.541 . . . . 10.0 111.558 -179.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 34.9 p -118.07 155.24 51.52 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.539 -0.755 . . . . 10.0 109.172 178.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_exo -68.96 -7.55 21.09 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.518 2.146 . . . . 10.0 112.805 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -86.51 -33.5 20.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.42 -0.354 . . . . 10.0 111.235 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.426 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 11.2 pt-20 -85.48 174.91 9.15 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.619 -0.432 . . . . 10.0 110.006 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 87.6 mt 73.04 -59.46 0.57 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.318 0.647 . . . . 10.0 110.701 -179.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 132.07 61.63 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.592 -0.813 . . . . 10.0 113.033 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 49.5 mtt -98.42 133.59 42.59 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.354 -0.239 . . . . 10.0 110.354 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.2 mm-40 -132.62 -176.96 4.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.183 0.516 . . . . 10.0 111.436 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -70.06 140.1 52.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.154 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 63.95 27.62 14.38 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 123.526 0.516 . . . . 10.0 111.231 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -74.07 171.12 14.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.04 0.448 . . . . 10.0 111.397 -179.432 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.5 t -121.12 132.73 69.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.898 -178.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 20.5 tt -138.89 140.88 37.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 110.165 -0.309 . . . . 10.0 110.165 179.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -103.35 156.17 17.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.699 -179.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.4 p -143.27 127.27 14.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.112 0.482 . . . . 10.0 110.219 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -136.66 165.23 26.38 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.971 -0.558 . . . . 10.0 110.039 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -90.38 136.81 32.82 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 110.353 -0.239 . . . . 10.0 110.353 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.514 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.1 mm-40 -67.66 164.94 18.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.709 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -68.64 -26.94 65.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.082 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 34.1 p -74.7 -30.86 61.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.36 0.6 . . . . 10.0 110.769 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.98 20.4 67.89 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.208 -0.757 . . . . 10.0 111.208 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.671 -1.072 . . . . 10.0 111.302 -179.596 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 64.2 t30 . . . . . 0 N--CA 1.482 1.153 0 CA-C-O 121.364 0.602 . . . . 10.0 110.492 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . 0.422 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 42.5 t30 -119.15 123.09 43.53 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.265 -1.013 . . . . 10.0 108.265 179.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . 0.441 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 13.5 ptt180 -124.14 125.4 44.41 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 120.156 -0.617 . . . . 10.0 111.053 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . 0.45 ' CG ' HH21 ' A' ' 54' ' ' ARG . 30.9 t0 -124.13 130.18 24.47 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 107.544 -1.28 . . . . 10.0 107.544 176.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -108.18 129.51 0.05 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.516 0 C-N-CA 121.969 1.779 . . . . 10.0 111.848 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 10.6 mt -117.35 136.75 53.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 114.695 -1.139 . . . . 10.0 110.276 -178.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 11.4 t -112.17 135.69 50.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.984 -178.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . 0.492 HD11 ' HG3' ' A' ' 46' ' ' LYS . 8.7 tp . . . . . 0 C--N 1.317 -0.807 0 CA-C-N 114.878 -1.055 . . . . 10.0 111.439 -176.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 . . . . . 0 N--CA 1.477 0.905 0 N-CA-C 110.162 -0.31 . . . . 10.0 110.162 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.4 mm -109.68 119.17 58.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 109.408 -0.59 . . . . 10.0 109.408 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.499 ' HB3' ' HZ3' ' A' ' 23' ' ' LYS . 6.8 ttpm? -96.28 108.65 21.17 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.19 0.519 . . . . 10.0 110.835 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.8 mt -98.3 136.58 38.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.573 179.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 78.3 mttt -97.56 112.84 24.54 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.138 0.494 . . . . 10.0 110.596 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.4 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.8 t -91.95 135.24 27.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.153 -179.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 32.6 mm -90.72 108.39 19.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.619 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.422 ' HA3' ' OG ' ' A' ' 32' ' ' SER . . . -80.71 150.33 31.03 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.809 -0.71 . . . . 10.0 112.043 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -64.08 -22.67 67.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.846 0.355 . . . . 10.0 111.516 -179.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -96.49 26.73 4.21 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.717 0.294 . . . . 10.0 110.92 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 29.5 m 60.63 45.06 10.76 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.502 0.667 . . . . 10.0 110.864 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.422 ' OG ' ' HA3' ' A' ' 28' ' ' GLY . 3.8 p -106.65 149.48 27.19 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.395 -0.821 . . . . 10.0 110.608 -179.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 28.1 tt0 -108.73 97.34 7.0 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.228 -0.656 . . . . 10.0 109.228 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.423 HG21 HD12 ' A' ' 34' ' ' ILE . 0.8 OUTLIER -86.23 126.24 40.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.658 -178.928 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.8 m170 -101.99 96.79 7.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.114 0.483 . . . . 10.0 109.946 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -89.32 109.98 20.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.923 -0.581 . . . . 10.0 110.425 -179.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -89.72 91.56 8.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.321 179.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.405 ' HA ' ' CG2' ' B' ' 364' ' ' ILE . 5.1 m -100.93 -174.54 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.761 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -135.11 143.85 46.83 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.955 -0.387 . . . . 10.0 109.955 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.444 ' C ' ' HG1' ' A' ' 41' ' ' THR . 60.8 tpp -78.42 60.83 2.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.408 0.623 . . . . 10.0 110.555 -179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.444 ' HG1' ' C ' ' A' ' 40' ' ' MET . 28.2 m -161.69 -38.76 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.605 -0.725 . . . . 10.0 109.597 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.59 153.61 38.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.482 -0.781 . . . . 10.0 111.628 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -80.07 151.48 29.86 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.387 -0.824 . . . . 10.0 110.019 179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 74.7 mt -72.07 -10.63 60.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.743 0.306 . . . . 10.0 110.758 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -59.91 -46.68 88.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.981 178.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.9 tppp? -62.99 -41.0 99.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.411 -0.813 . . . . 10.0 110.778 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.07 -41.58 94.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.915 -178.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -58.79 -47.56 84.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.285 -0.416 . . . . 10.0 112.015 -179.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -74.39 -38.22 63.18 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.717 -0.393 . . . . 10.0 111.674 -179.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 63.5 m -59.56 -34.01 72.14 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.888 0.375 . . . . 10.0 110.744 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -69.78 -41.66 74.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.332 -0.395 . . . . 10.0 109.937 178.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.552 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 79.4 m -62.1 -43.38 98.95 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.327 -0.397 . . . . 10.0 109.939 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -63.37 -36.38 83.53 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.215 0.531 . . . . 10.0 110.175 179.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -65.32 -40.33 93.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.404 179.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -77.68 -22.73 50.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.07 -0.513 . . . . 10.0 110.949 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.43 24.96 29.56 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.326 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.5 m -124.07 154.43 68.13 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 110.394 -0.225 . . . . 10.0 110.394 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -61.18 153.05 67.65 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.473 2.116 . . . . 10.0 111.608 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.552 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 17.2 ttt -65.82 152.38 44.51 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 121.232 -0.187 . . . . 10.0 110.889 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.5 t30 82.53 -3.78 1.38 Allowed 'General case' 0 N--CA 1.472 0.644 0 O-C-N 124.175 0.922 . . . . 10.0 111.681 179.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.4 p -79.0 -24.35 43.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.202 0.525 . . . . 10.0 110.326 179.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.1 mt -117.82 131.48 56.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.124 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.428 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 16.6 ptt-85 -104.1 138.27 40.84 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.322 179.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.401 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 73.4 m-85 -100.41 127.26 46.78 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.139 -0.482 . . . . 10.0 109.924 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt -112.17 117.09 31.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.048 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -117.52 107.19 13.98 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.291 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 59.1 34.29 23.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.092 0.472 . . . . 10.0 111.02 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.61 -3.11 87.31 Favored Glycine 0 CA--C 1.518 0.262 0 CA-C-N 115.849 -0.614 . . . . 10.0 113.103 179.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -106.7 128.51 54.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.871 0.336 . . . . 10.0 110.494 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 13.9 ptm180 -76.25 126.66 31.39 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.074 0.464 . . . . 10.0 110.532 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.4 mm -66.78 123.6 20.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.577 -0.738 . . . . 10.0 110.953 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -84.74 170.9 12.79 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.674 -0.693 . . . . 10.0 110.787 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.48 5.54 17.46 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.96 -0.564 . . . . 10.0 111.147 -179.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -130.32 18.16 5.41 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.708 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.3 m170 -88.94 159.46 17.64 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.07 0.462 . . . . 10.0 111.114 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.476 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -131.34 153.47 81.65 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.595 -0.729 . . . . 10.0 110.075 179.678 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.2 -17.82 55.08 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.393 2.062 . . . . 10.0 112.325 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -70.68 -36.67 73.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.925 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 76' ' ' THR . 11.2 pt-20 -85.87 167.23 15.34 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.434 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 84.9 mt 73.79 -51.36 0.69 Allowed 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.208 0.603 . . . . 10.0 110.63 -179.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 117.02 61.41 0.31 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.006 -0.616 . . . . 10.0 113.022 178.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 44.4 mtt -87.32 125.05 33.99 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.759 0.314 . . . . 10.0 110.311 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.497 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 7.4 mm-40 -123.74 177.6 5.63 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.135 0.493 . . . . 10.0 111.336 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.421 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 21.7 tp10 -70.25 142.09 52.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.706 179.407 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . 0.412 ' HG2' ' HG3' ' A' ' 84' ' ' GLU . 70.2 mm-40 68.23 25.06 7.31 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 123.464 0.477 . . . . 10.0 111.039 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.497 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.1 t70 -76.52 162.16 28.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.523 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 95.4 t -117.17 125.52 73.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.869 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 19.4 tt -129.4 137.55 56.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.061 -0.518 . . . . 10.0 109.959 179.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -103.49 149.56 24.73 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.898 0.38 . . . . 10.0 111.536 -178.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -132.06 130.89 61.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.835 -0.621 . . . . 10.0 109.808 179.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -134.77 157.62 46.28 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.761 0.315 . . . . 10.0 111.138 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -75.4 129.73 37.82 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.679 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.428 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 3.1 mm-40 -79.15 152.65 30.6 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.742 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -77.05 0.15 22.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.707 -0.679 . . . . 10.0 111.433 -178.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.4 p -88.31 -27.86 21.42 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.086 0.469 . . . . 10.0 110.525 179.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.09 16.3 80.66 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.674 -179.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.945 -0.919 . . . . 10.0 110.965 -179.589 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 29.6 t30 . . . . . 0 N--CA 1.483 1.177 0 CA-C-O 120.458 0.171 . . . . 10.0 110.886 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -120.19 119.83 34.37 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 119.703 -0.799 . . . . 10.0 109.451 178.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . 0.503 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 18.4 ptt180 -130.01 129.76 44.12 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.377 0.51 . . . . 10.0 112.377 179.06 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . 0.424 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 23.8 t70 -121.85 129.96 24.94 Favored Pre-proline 0 C--N 1.316 -0.867 0 N-CA-C 107.31 -1.367 . . . . 10.0 107.31 175.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 71.7 Cg_endo -108.37 129.11 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.107 0 C-N-CA 121.651 1.567 . . . . 10.0 112.581 -179.072 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 7.4 mt -117.84 136.36 55.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 114.182 -1.372 . . . . 10.0 110.735 -177.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 99.3 t -114.28 135.2 54.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 108.509 -0.923 . . . . 10.0 108.509 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . 0.43 HD13 ' HA ' ' B' ' 364' ' ' ILE . 8.3 tp . . . . . 0 C--N 1.315 -0.913 0 CA-C-N 114.818 -1.083 . . . . 10.0 112.261 -176.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 N--CA 1.481 1.08 0 CA-C-O 120.84 0.353 . . . . 10.0 110.624 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.8 mm -122.44 117.05 50.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 179.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.549 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.9 ttpm? -93.15 119.49 32.41 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.132 0.491 . . . . 10.0 111.021 -179.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 59.2 mt -102.27 142.38 33.59 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.762 -0.654 . . . . 10.0 110.096 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.3 mtpt -100.12 100.91 11.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.958 0.409 . . . . 10.0 110.481 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.604 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.3 t -86.17 118.01 31.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.8 mm -97.18 112.65 29.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.025 0.441 . . . . 10.0 111.511 -178.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.26 160.09 37.89 Favored Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 110.901 -0.88 . . . . 10.0 110.901 178.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -66.74 -19.35 65.73 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.911 0.355 . . . . 10.0 111.354 -179.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.39 27.65 3.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.52 -0.309 . . . . 10.0 111.047 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.0 m 62.28 33.79 16.35 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.51 179.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.58 110.14 22.27 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.459 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.4 ' OE1' ' N ' ' B' ' 357' ' ' ASN . 8.7 mt-10 -91.79 98.94 11.92 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.252 -0.647 . . . . 10.0 109.252 178.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.414 HD13 HG21 ' A' ' 34' ' ' ILE . 5.1 mm -87.04 127.82 40.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.467 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.434 ' ND1' ' HE3' ' A' ' 23' ' ' LYS . 14.7 m-70 -103.46 85.66 2.51 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -89.92 119.12 30.02 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.566 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -90.91 101.41 14.17 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.136 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 m -97.57 172.1 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.777 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -123.51 141.31 52.13 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.819 -0.437 . . . . 10.0 109.819 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.503 ' SD ' ' HB2' ' A' ' 77' ' ' PRO . 41.4 tpp -78.26 54.23 1.35 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.078 0.466 . . . . 10.0 111.548 -179.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 52.7 m -154.64 -45.15 0.09 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.221 179.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.32 153.05 40.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.693 179.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -79.25 155.82 28.38 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.005 -0.739 . . . . 10.0 109.005 179.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 78.3 mt -69.81 -8.22 46.42 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.78 0.324 . . . . 10.0 111.172 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 47.8 tptt -58.98 -49.47 77.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.989 -0.551 . . . . 10.0 109.98 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.9 tppp? -59.64 -41.55 90.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.34 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.46 -40.22 95.28 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.418 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -63.95 -45.31 89.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.321 -0.4 . . . . 10.0 112.053 -179.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -73.7 -39.29 64.46 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.668 -0.413 . . . . 10.0 111.536 -179.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.464 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 67.6 m -64.92 -32.47 74.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.825 0.345 . . . . 10.0 111.09 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -65.62 -38.46 89.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.057 0.456 . . . . 10.0 110.391 179.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.499 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 60.2 m -63.01 -36.07 82.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.714 -0.676 . . . . 10.0 110.138 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.464 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 74.2 mt-30 -67.91 -34.18 76.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.802 -0.635 . . . . 10.0 110.515 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -67.43 -38.44 84.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.578 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -80.89 -34.48 33.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.309 -179.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 99.97 37.13 3.98 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.69 -0.767 . . . . 10.0 112.168 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.428 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 2.5 m -137.1 155.82 75.89 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 109.984 -0.376 . . . . 10.0 109.984 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -69.17 155.19 68.65 Favored 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.18 1.92 . . . . 10.0 111.382 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.499 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 11.9 ttt -64.09 158.02 23.87 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 121.097 -0.241 . . . . 10.0 111.176 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.6 t30 81.03 -0.48 1.76 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.75 0.82 . . . . 10.0 111.461 179.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 57.1 p -86.25 -29.5 23.06 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.17 0.509 . . . . 10.0 110.441 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 25.0 mt -119.06 140.47 50.01 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.795 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.48 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 21.4 ptt-85 -117.44 141.59 48.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.159 179.225 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -96.83 129.72 44.22 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.138 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt -107.58 116.07 31.29 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.963 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -124.68 113.31 17.82 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 61.56 32.55 18.64 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 123.484 0.49 . . . . 10.0 110.964 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.67 -13.79 57.61 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.018 -0.61 . . . . 10.0 113.104 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -100.27 147.35 25.85 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.913 0.387 . . . . 10.0 110.651 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -89.33 126.69 35.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.004 0.43 . . . . 10.0 110.523 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 42.9 mm -63.77 125.26 20.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.568 -0.742 . . . . 10.0 111.191 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.64 -179.25 7.27 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.946 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 1.5 m-20 -88.92 -2.6 58.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.49 -0.323 . . . . 10.0 111.338 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -119.37 12.07 12.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.683 0.278 . . . . 10.0 111.142 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -84.16 153.89 23.42 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.112 0.482 . . . . 10.0 111.722 -179.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.427 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 35.6 p -124.73 157.48 65.77 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.55 -0.75 . . . . 10.0 109.636 178.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . 0.503 ' HB2' ' SD ' ' A' ' 40' ' ' MET . 14.9 Cg_exo -69.23 -12.54 34.15 Favored 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 122.382 2.055 . . . . 10.0 112.692 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -77.07 -41.24 43.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.641 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 10.6 pt-20 -77.94 160.17 28.39 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 179.243 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 33.9 mt 73.69 -43.65 0.55 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.506 0.504 . . . . 10.0 110.379 -178.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.408 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 105.18 74.72 0.96 Allowed Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.965 -0.636 . . . . 10.0 113.55 178.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 36.6 mtt -96.74 131.74 43.15 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.688 -0.486 . . . . 10.0 109.688 178.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.538 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.3 mm-40 -129.9 179.01 6.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.939 0.4 . . . . 10.0 111.47 -179.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.549 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 20.7 tp10 -69.0 142.41 54.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.587 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 66.39 19.89 10.96 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 123.687 0.617 . . . . 10.0 111.249 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.538 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.8 OUTLIER -69.78 138.73 52.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.29 -0.413 . . . . 10.0 110.144 179.96 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.7 t -93.82 120.03 42.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.859 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.604 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 18.3 tt -133.28 139.48 49.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 179.387 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -112.15 154.28 25.73 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.901 0.382 . . . . 10.0 111.114 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.7 p -128.53 136.21 60.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.802 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -135.59 157.14 47.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.583 0.23 . . . . 10.0 110.823 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -74.41 136.61 42.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.553 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.48 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 6.1 mm-40 -71.39 161.54 30.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.905 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -65.37 -34.04 77.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.827 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.3 p -69.96 -30.2 67.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.002 0.43 . . . . 10.0 110.704 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.27 3.42 87.14 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 121.048 -0.596 . . . . 10.0 111.933 -179.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.961 0 CA-C-O 118.745 -1.031 . . . . 10.0 111.13 -179.889 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . 0.4 ' N ' ' OE1' ' A' ' 33' ' ' GLU . 4.8 p-10 . . . . . 0 N--CA 1.483 1.192 0 N-CA-C 111.395 0.146 . . . . 10.0 111.395 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -119.88 123.76 44.39 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 109.033 -0.729 . . . . 10.0 109.033 179.049 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -125.49 126.47 44.94 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.963 0.727 . . . . 10.0 112.963 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . 0.448 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 39.2 t70 -126.67 127.42 24.49 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 175.538 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 61.4 Cg_endo -110.92 126.03 0.03 OUTLIER 'Trans proline' 0 CA--C 1.536 0.593 0 C-N-CA 121.926 1.75 . . . . 10.0 113.414 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 3.4 mt -122.97 136.73 58.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 114.908 -1.042 . . . . 10.0 110.409 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 43.4 t -113.54 135.66 52.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.014 0.435 . . . . 10.0 110.006 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 7.1 tp . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 115.242 -0.89 . . . . 10.0 111.428 -176.82 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 109.709 -0.478 . . . . 10.0 109.709 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.491 ' O ' HG22 ' A' ' 38' ' ' VAL . 34.1 mm -73.35 112.25 9.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.954 0.407 . . . . 10.0 110.553 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.497 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -97.18 101.11 12.61 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.102 0.477 . . . . 10.0 110.114 179.601 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 69.9 mt -82.89 157.54 23.04 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.738 -0.664 . . . . 10.0 110.37 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.459 ' HA ' ' O ' ' A' ' 34' ' ' ILE . 77.8 tttt -120.94 109.03 14.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.938 0.399 . . . . 10.0 110.675 179.437 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.451 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 3.2 t -92.23 128.05 44.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 179.108 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.1 mm -107.22 122.44 61.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.897 0.379 . . . . 10.0 111.068 -179.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -100.78 167.85 20.08 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.756 179.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -65.74 -16.14 63.5 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.231 0.538 . . . . 10.0 110.994 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.2 p-10 -92.24 18.41 8.28 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.254 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.2 m 58.08 42.78 21.88 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.413 0.625 . . . . 10.0 110.96 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -90.75 149.32 22.06 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.322 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.52 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 42.5 mt-10 -116.91 86.95 2.6 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.249 -0.649 . . . . 10.0 109.249 178.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.459 ' O ' ' HA ' ' A' ' 25' ' ' LYS . 44.2 mm -79.04 118.69 26.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.151 -179.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 20.6 m170 -102.16 89.29 3.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.947 -0.76 . . . . 10.0 108.947 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -92.03 116.0 28.55 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.854 -178.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -90.44 97.88 11.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.035 -0.529 . . . . 10.0 109.587 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.491 HG22 ' O ' ' A' ' 22' ' ' ILE . 2.8 m -100.77 170.42 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.61 -179.488 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.1 tttt -122.33 141.07 51.93 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.404 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 62.3 tpp -79.37 75.14 5.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.559 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -176.92 -41.8 0.01 OUTLIER 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.383 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.93 147.49 36.93 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.764 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.7 m80 -75.61 153.37 37.33 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 53.6 mt -69.93 -4.97 22.96 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.752 0.31 . . . . 10.0 111.324 -179.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 46.2 tptt -61.36 -48.79 79.66 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -62.91 -35.23 79.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.276 -0.874 . . . . 10.0 110.256 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.77 -46.97 70.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.683 -0.69 . . . . 10.0 111.031 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -60.57 -44.16 96.49 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.998 -0.546 . . . . 10.0 112.11 -179.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -70.81 -41.93 70.92 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.97 -0.292 . . . . 10.0 111.655 -178.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.9 m -64.47 -32.47 74.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.705 0.288 . . . . 10.0 111.222 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -68.77 -35.02 76.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.848 0.356 . . . . 10.0 110.24 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.48 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 85.6 m -62.37 -40.02 95.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.181 0.515 . . . . 10.0 109.927 179.211 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -67.36 -30.73 70.61 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.364 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -68.27 -30.0 68.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.221 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -98.48 -4.95 33.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.319 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.63 36.88 62.03 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.878 -0.677 . . . . 10.0 112.54 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 13.4 m -130.5 152.53 80.49 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 110.067 -0.346 . . . . 10.0 110.067 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -69.82 158.16 57.81 Favored 'Trans proline' 0 N--CA 1.466 -0.13 0 C-N-CA 122.256 1.971 . . . . 10.0 111.443 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.48 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 12.0 ttt -66.74 157.65 32.25 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.959 -0.296 . . . . 10.0 110.348 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.9 t30 79.06 -5.88 1.95 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.483 0.713 . . . . 10.0 111.46 179.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.4 p -81.72 -24.16 36.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.855 0.359 . . . . 10.0 110.832 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 79.2 mt -119.02 143.36 47.12 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.907 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.497 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 16.5 ptt-85 -116.18 128.14 55.38 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.172 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -90.8 128.31 36.66 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.05 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.7 mt -111.01 131.22 55.23 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.62 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -143.03 117.41 9.64 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.56 -0.745 . . . . 10.0 109.97 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 61.07 29.66 19.05 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.782 -0.645 . . . . 10.0 111.883 179.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.41 -4.77 85.89 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.71 -0.757 . . . . 10.0 112.784 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -112.78 156.2 23.27 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.187 -0.301 . . . . 10.0 110.187 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -95.66 134.96 37.96 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.072 0.463 . . . . 10.0 110.679 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 37.3 mm -71.79 115.88 12.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.478 -0.783 . . . . 10.0 110.321 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.41 167.05 21.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.169 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.59 11.17 2.18 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.765 -178.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -133.56 11.96 4.09 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.107 0.479 . . . . 10.0 110.325 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -81.93 151.7 27.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.521 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.423 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 31.9 p -125.02 153.46 71.27 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.003 179.18 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -66.96 -12.51 36.39 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 122.461 2.107 . . . . 10.0 112.454 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -75.8 -35.82 59.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.706 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 76' ' ' THR . 9.9 pt-20 -91.25 170.26 10.15 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.827 -0.434 . . . . 10.0 109.827 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mt 72.63 -49.79 0.7 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.261 0.625 . . . . 10.0 110.999 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.82 76.26 0.59 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 121.022 -0.608 . . . . 10.0 112.496 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 34.9 mtt -106.52 123.77 48.59 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.997 -0.372 . . . . 10.0 109.997 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.532 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 5.1 mm-40 -122.17 178.87 4.74 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.307 0.575 . . . . 10.0 112.013 -179.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.497 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 28.3 tp10 -67.7 137.58 55.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.462 -0.79 . . . . 10.0 109.945 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 65.3 27.79 11.99 Favored 'General case' 0 N--CA 1.464 0.249 0 O-C-N 123.61 0.569 . . . . 10.0 111.112 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.532 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.6 t0 -77.0 142.08 40.08 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.305 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 29.6 t -91.45 120.88 41.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.055 -0.521 . . . . 10.0 111.37 -179.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 15.3 tt -129.49 142.78 43.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 108.954 -0.758 . . . . 10.0 108.954 178.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -119.14 153.61 34.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.029 0.442 . . . . 10.0 111.449 -178.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.9 p -135.73 133.84 51.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.851 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -134.04 164.3 27.64 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.617 -0.265 . . . . 10.0 110.677 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -72.87 134.31 44.78 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.481 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.497 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 0.7 OUTLIER -72.08 164.48 26.08 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.231 179.931 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -68.06 -36.45 79.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.502 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.0 p -71.18 -30.26 66.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.11 0.481 . . . . 10.0 111.008 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.73 5.4 89.88 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.579 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.829 -0.984 . . . . 10.0 111.012 -179.802 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 22.0 m120 . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.512 0.196 . . . . 10.0 111.228 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . 0.52 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 54.5 t30 -119.6 119.62 34.31 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 177.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . 0.493 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 14.1 ptt85 -126.59 129.58 48.82 Favored 'General case' 0 CA--C 1.506 -0.722 0 C-N-CA 119.857 -0.737 . . . . 10.0 112.094 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . 0.431 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 31.7 t70 -121.8 132.48 24.23 Favored Pre-proline 0 C--N 1.311 -1.09 0 N-CA-C 107.298 -1.371 . . . . 10.0 107.298 177.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 58.5 Cg_endo -106.81 129.69 0.05 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.438 0 C-N-CA 121.914 1.742 . . . . 10.0 112.328 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 9.5 mt -118.97 136.92 54.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 113.884 -1.507 . . . . 10.0 110.774 -178.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 52.6 t -113.39 135.07 54.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.295 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 9.3 tp . . . . . 0 C--N 1.32 -0.697 0 CA-C-N 114.951 -1.022 . . . . 10.0 110.546 -176.476 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 110.178 -0.304 . . . . 10.0 110.178 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.7 mm -112.82 117.51 55.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.778 -0.453 . . . . 10.0 109.778 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.465 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.7 OUTLIER -97.06 102.95 14.84 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.138 0.494 . . . . 10.0 110.796 -179.463 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 45.3 mt -82.79 146.96 28.67 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.872 -0.604 . . . . 10.0 109.808 179.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.7 ttpt -110.95 99.54 8.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.011 0.434 . . . . 10.0 109.986 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.42 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.9 t -78.16 133.05 31.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.929 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 15.4 mm -92.1 110.29 22.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.902 -179.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.437 ' HA3' ' OG ' ' A' ' 32' ' ' SER . . . -83.0 160.49 38.8 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.625 -0.798 . . . . 10.0 112.053 179.208 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -64.02 -31.97 73.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.791 0.329 . . . . 10.0 111.334 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -92.03 25.85 2.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.055 0.455 . . . . 10.0 110.468 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.1 m 63.4 32.95 14.17 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.502 -0.772 . . . . 10.0 111.003 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.437 ' OG ' ' HA3' ' A' ' 28' ' ' GLY . 0.3 OUTLIER -84.9 129.94 34.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.526 -0.761 . . . . 10.0 109.989 179.397 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -97.99 94.83 7.08 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.591 -0.522 . . . . 10.0 109.591 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.42 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 4.6 mm -77.9 121.75 31.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.209 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.6 m170 -101.97 89.24 3.57 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.276 -0.42 . . . . 10.0 109.88 -179.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.473 ' CE2' HD11 ' B' ' 362' ' ' ILE . 0.1 OUTLIER -96.29 118.48 32.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.296 -179.663 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -91.57 102.02 14.67 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.387 -0.369 . . . . 10.0 110.174 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.2 m -100.4 170.94 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.587 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -123.16 135.44 54.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.063 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 60.8 tpp -75.49 74.39 2.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.038 -179.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.0 t 178.25 -30.96 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.481 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.68 153.27 22.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.895 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -75.78 150.47 37.75 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.114 179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 34.8 mt -70.0 -9.96 56.99 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.327 -0.397 . . . . 10.0 111.494 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.9 tptt -59.78 -47.18 86.74 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 178.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.439 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.6 tppp? -60.49 -29.74 69.26 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.65 -0.705 . . . . 10.0 110.59 179.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.404 HD11 ' HA ' ' A' ' 47' ' ' LEU . 3.8 mm? -79.66 -41.07 27.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.229 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -65.56 -35.36 80.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.268 -0.424 . . . . 10.0 111.111 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.413 ' OE2' ' HG3' ' A' ' 59' ' ' MET . 2.6 mm-40 -71.38 -43.85 66.09 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.103 -179.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.3 p -66.57 -37.8 85.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.685 -178.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -59.86 -45.13 93.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.698 0.285 . . . . 10.0 110.454 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.439 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.3 m -60.45 -42.63 96.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.049 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -63.68 -38.45 91.15 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.45 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 -65.38 -36.74 84.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.398 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -76.04 -20.59 57.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.969 -0.559 . . . . 10.0 110.375 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 86.53 26.99 31.13 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.787 -0.642 . . . . 10.0 112.525 179.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.2 m -131.93 158.82 74.44 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 110.453 -0.203 . . . . 10.0 110.453 -179.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.23 166.01 18.08 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.452 2.101 . . . . 10.0 112.02 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.439 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 0.2 OUTLIER -72.2 159.39 34.19 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.907 -179.621 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 t30 69.31 13.81 8.52 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.328 0.651 . . . . 10.0 111.49 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 38.9 p -89.2 -22.69 22.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.255 0.55 . . . . 10.0 109.776 178.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 mt -127.7 142.24 51.38 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.482 -0.781 . . . . 10.0 110.591 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.7 ptt-85 -112.05 130.65 55.8 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.013 -0.539 . . . . 10.0 110.024 179.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.48 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 98.0 m-85 -90.65 131.99 36.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.439 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 93.7 mt -113.97 120.11 39.53 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.14 0.495 . . . . 10.0 111.03 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -127.24 112.73 15.44 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.554 -0.906 . . . . 10.0 108.554 179.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 65.65 25.6 11.56 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.089 0.471 . . . . 10.0 110.265 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.92 -14.77 62.45 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.753 -0.658 . . . . 10.0 112.749 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -98.85 148.07 24.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.776 0.322 . . . . 10.0 110.809 -179.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.48 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 14.2 ptm180 -85.3 132.19 34.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.964 0.411 . . . . 10.0 110.519 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 41.8 mm -71.24 127.1 32.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.224 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.3 -173.7 3.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.647 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -93.22 -33.36 14.01 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.035 0.445 . . . . 10.0 110.698 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -90.3 4.91 49.34 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.779 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -73.57 147.11 44.21 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.637 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.543 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -124.97 151.22 68.51 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.876 179.479 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -62.65 -15.86 49.06 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.527 2.151 . . . . 10.0 112.413 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -64.92 -41.92 95.14 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.285 179.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.543 ' HG2' ' O ' ' A' ' 76' ' ' THR . 7.7 pt-20 -89.11 171.67 9.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.806 -0.634 . . . . 10.0 109.599 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 18.3 mt 73.23 -49.49 0.69 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.689 0.618 . . . . 10.0 111.139 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.39 76.57 0.83 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 121.101 -0.571 . . . . 10.0 112.27 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 43.9 mtt -106.43 125.67 51.29 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.718 0.294 . . . . 10.0 110.38 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.495 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.2 mm-40 -124.75 178.61 5.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.04 0.448 . . . . 10.0 111.235 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.465 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 19.2 tp10 -67.86 138.67 56.25 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.476 179.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 64.51 26.34 13.37 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 123.614 0.571 . . . . 10.0 111.429 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.495 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -71.17 155.6 40.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.421 179.919 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 57.3 t -99.15 120.82 49.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.135 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 11.4 tt -136.45 136.59 48.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.225 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -113.07 159.25 19.38 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.795 0.331 . . . . 10.0 111.081 -179.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.3 p -142.16 131.19 22.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.425 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -131.16 158.69 39.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.402 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -71.24 138.0 49.09 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.82 0.343 . . . . 10.0 110.937 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -75.08 160.78 30.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.857 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -64.9 -42.65 94.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.991 -0.549 . . . . 10.0 110.313 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.97 -40.71 96.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.571 -0.74 . . . . 10.0 111.5 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 99.8 -16.23 58.78 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.825 -0.702 . . . . 10.0 112.458 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.001 0 CA-C-O 119.174 -0.792 . . . . 10.0 111.551 -179.946 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 65.4 t30 . . . . . 0 N--CA 1.487 1.413 0 CA-C-O 121.028 0.442 . . . . 10.0 110.79 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -120.88 121.35 37.9 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.291 -1.003 . . . . 10.0 108.291 178.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 23.9 ptt180 -127.51 130.14 48.65 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 112.454 0.538 . . . . 10.0 112.454 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . 0.469 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 31.0 t70 -120.12 128.79 25.66 Favored Pre-proline 0 C--N 1.317 -0.842 0 N-CA-C 105.632 -1.988 . . . . 10.0 105.632 175.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 48.8 Cg_endo -108.64 127.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.237 0 C-N-CA 121.542 1.494 . . . . 10.0 113.688 -177.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . 0.473 HD11 ' CE2' ' A' ' 36' ' ' PHE . 1.7 mt -121.19 134.54 64.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 114.147 -1.388 . . . . 10.0 110.182 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 77.8 t -114.68 136.43 51.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.18 -0.674 . . . . 10.0 109.18 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . 0.439 HD11 ' HG3' ' A' ' 46' ' ' LYS . 7.9 tp . . . . . 0 C--N 1.315 -0.91 0 CA-C-N 114.766 -1.107 . . . . 10.0 111.316 -176.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 . . . . . 0 N--CA 1.479 1.021 0 CA-C-O 120.692 0.282 . . . . 10.0 110.271 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.0 mm -122.78 108.4 21.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.496 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.7 OUTLIER -94.82 106.17 18.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.218 0.532 . . . . 10.0 110.677 -179.667 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 30.5 mt -90.76 146.92 23.58 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.231 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.9 mtpt -109.44 105.51 14.89 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.932 -0.395 . . . . 10.0 109.932 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.461 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.5 t -86.7 131.4 34.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.739 179.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.5 mm -84.83 104.41 12.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.278 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -72.25 152.13 47.87 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.82 -0.705 . . . . 10.0 112.172 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -61.2 -28.97 69.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.823 0.345 . . . . 10.0 110.981 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -96.14 23.94 6.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.754 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 m 64.77 34.41 9.5 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.089 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.2 p -92.47 142.5 27.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.475 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.446 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 24.4 mt-10 -98.12 102.34 14.06 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.947 -0.39 . . . . 10.0 109.947 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.461 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 9.1 mm -87.49 117.04 30.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.332 -0.395 . . . . 10.0 110.331 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -97.03 92.62 6.16 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.856 -0.424 . . . . 10.0 109.856 179.553 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.34 108.03 20.48 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.993 -0.373 . . . . 10.0 109.993 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -88.28 102.26 14.66 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.795 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -101.84 167.51 2.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.119 -0.492 . . . . 10.0 111.091 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 67.6 tttt -115.82 133.06 56.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.004 -0.544 . . . . 10.0 109.559 179.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.484 ' O ' ' HB ' ' A' ' 41' ' ' THR . 59.5 tpp -75.47 80.33 2.51 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.363 -0.38 . . . . 10.0 111.127 -179.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.484 ' HB ' ' O ' ' A' ' 40' ' ' MET . 14.7 t 172.04 -27.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.371 179.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.7 150.69 26.59 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.861 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.3 m80 -71.09 144.89 50.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.363 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.0 mt -67.71 -12.8 61.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.966 0.412 . . . . 10.0 110.293 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.8 tptt -57.91 -47.93 81.39 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.794 178.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.431 ' HA ' ' OE1' ' A' ' 49' ' ' GLU . 4.9 tppp? -62.57 -33.56 75.2 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.178 -0.919 . . . . 10.0 110.708 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -71.33 -37.48 71.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.873 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -68.87 -46.6 68.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.773 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.431 ' OE1' ' HA ' ' A' ' 46' ' ' LYS . 14.8 pt-20 -66.68 -43.41 84.55 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.586 0.217 . . . . 10.0 111.586 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.429 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 19.3 m -64.15 -33.47 75.85 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.809 0.3 . . . . 10.0 111.809 -179.164 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -65.06 -42.7 93.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.791 0.329 . . . . 10.0 110.298 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.419 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 39.6 m -61.81 -39.46 91.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.183 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.429 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.4 mt-30 -63.68 -36.92 85.42 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.359 179.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -67.38 -37.51 83.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.546 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -79.67 -13.74 59.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.943 -0.571 . . . . 10.0 111.003 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.59 27.92 56.18 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.254 -0.498 . . . . 10.0 112.687 179.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.5 m -129.25 151.27 77.49 Favored Pre-proline 0 C--N 1.328 -0.365 0 O-C-N 122.663 -0.316 . . . . 10.0 110.698 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.84 151.73 75.18 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.504 2.136 . . . . 10.0 111.678 179.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.419 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 19.4 ttt -63.81 159.24 19.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.495 -0.321 . . . . 10.0 111.058 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.6 t30 78.18 4.07 2.77 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.662 0.785 . . . . 10.0 111.751 179.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.3 p -92.43 -20.21 21.25 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.874 0.369 . . . . 10.0 111.017 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.1 mt -116.75 136.54 52.88 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.279 -0.418 . . . . 10.0 111.245 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.441 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 28.0 ptt-85 -105.91 131.49 53.15 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.909 179.152 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -99.13 119.56 38.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.833 -0.621 . . . . 10.0 109.777 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.7 mt -108.73 114.89 29.06 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.239 0.542 . . . . 10.0 111.385 -178.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -123.18 118.8 28.47 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.368 -0.975 . . . . 10.0 108.368 178.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 64.66 20.16 12.05 Favored 'General case' 0 N--CA 1.464 0.231 0 O-C-N 123.544 0.527 . . . . 10.0 110.342 -178.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.93 -13.12 68.1 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 115.755 -0.657 . . . . 10.0 112.719 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -98.17 150.84 21.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.822 0.344 . . . . 10.0 111.016 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.404 HH12 ' HD2' ' A' ' 70' ' ' ARG . 11.7 ptm180 -88.97 124.73 34.53 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.432 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.1 mm -66.04 126.73 25.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.614 -0.721 . . . . 10.0 111.022 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -84.15 -179.88 7.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.621 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.21 -5.94 57.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.901 0.381 . . . . 10.0 111.099 -179.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -113.38 14.7 19.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.995 0.426 . . . . 10.0 110.666 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 20.1 m170 -87.16 158.31 19.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.397 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.534 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 10.6 p -134.13 154.71 80.26 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.435 -0.802 . . . . 10.0 109.399 178.77 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.02 -9.59 25.57 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.352 2.035 . . . . 10.0 112.121 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -71.6 -34.19 69.66 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.6 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 76' ' ' THR . 5.5 pt-20 -92.78 171.99 8.63 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.006 -0.368 . . . . 10.0 110.006 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.7 mt 73.13 -44.45 0.59 Allowed 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.829 0.706 . . . . 10.0 111.051 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.4 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 107.87 60.53 0.56 Allowed Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 121.228 -0.511 . . . . 10.0 111.96 179.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 47.9 mtt -87.63 126.62 35.06 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.031 -0.359 . . . . 10.0 110.031 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 18.0 mm-40 -130.51 178.59 6.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.335 0.588 . . . . 10.0 112.136 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.496 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 20.3 tp10 -67.85 137.69 55.5 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.323 -0.853 . . . . 10.0 110.333 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 5.9 mm-40 69.46 26.64 5.13 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.615 0.572 . . . . 10.0 111.607 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.3 OUTLIER -80.98 146.87 30.49 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.956 -0.387 . . . . 10.0 109.956 179.343 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 98.5 t -100.64 127.67 53.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.206 -0.452 . . . . 10.0 111.0 -179.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.4 tt -132.2 146.63 32.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.654 -0.498 . . . . 10.0 109.654 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -110.34 152.22 26.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.848 0.356 . . . . 10.0 111.48 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 10.6 p -141.12 130.0 24.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.932 179.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -135.62 164.29 28.17 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.493 -0.322 . . . . 10.0 110.385 -179.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -83.4 132.07 35.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.771 0.319 . . . . 10.0 110.584 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.441 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.8 mm-40 -72.72 156.12 39.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.013 -0.54 . . . . 10.0 111.55 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -70.22 -22.0 62.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.492 -0.776 . . . . 10.0 111.273 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.9 p -77.34 -19.5 56.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.933 0.397 . . . . 10.0 111.241 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 74.19 10.71 81.73 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.741 -0.742 . . . . 10.0 111.642 -179.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.93 0 CA-C-O 118.65 -1.083 . . . . 10.0 111.202 -179.709 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 64.7 t30 . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 121.046 0.45 . . . . 10.0 110.76 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 358' ' ' ASN . . . . . 0.446 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 52.8 t30 -119.15 121.42 39.71 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 108.189 -1.041 . . . . 10.0 108.189 178.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 359' ' ' ARG . . . . . 0.412 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 24.9 ptt180 -128.73 130.22 46.81 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.642 0.608 . . . . 10.0 112.642 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 360' ' ' ASP . . . . . 0.435 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 32.9 t70 -119.87 131.49 24.39 Favored Pre-proline 0 C--N 1.318 -0.769 0 N-CA-C 107.018 -1.475 . . . . 10.0 107.018 175.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 361' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 68.5 Cg_endo -109.63 128.95 0.04 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 121.775 1.65 . . . . 10.0 113.911 -178.109 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 3.0 mt -118.1 135.72 57.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 114.316 -1.311 . . . . 10.0 110.1 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 59.0 t -114.68 136.61 50.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 108.889 -0.782 . . . . 10.0 108.889 -179.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 364' ' ' ILE . . . . . 0.406 HD11 ' HG3' ' A' ' 46' ' ' LYS . 6.4 tp . . . . . 0 C--N 1.316 -0.882 0 CA-C-N 115.354 -0.839 . . . . 10.0 112.149 -175.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 . . . . . 0 N--CA 1.479 1.0 0 CA-C-O 120.714 0.292 . . . . 10.0 110.517 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 32.4 mm -105.81 126.62 61.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.124 -0.489 . . . . 10.0 109.774 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.42 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.4 ttpm? -99.56 97.74 8.69 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.088 0.471 . . . . 10.0 110.546 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 69.5 mt -84.77 144.84 28.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.334 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.5 mtpt -102.53 107.78 18.86 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.932 0.396 . . . . 10.0 110.696 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.0 t -91.05 122.07 42.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 109.078 -0.712 . . . . 10.0 109.078 178.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 39.1 mm -91.15 108.59 20.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 120.933 0.397 . . . . 10.0 111.158 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.97 158.03 49.28 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.767 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -63.71 -22.09 66.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.63 0.252 . . . . 10.0 111.556 -178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -103.41 28.63 6.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.794 0.33 . . . . 10.0 111.42 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.7 m 65.69 27.53 11.29 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.693 -0.685 . . . . 10.0 112.243 178.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.29 125.8 35.25 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.558 -0.534 . . . . 10.0 109.558 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -97.5 102.54 14.33 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.19 0.519 . . . . 10.0 110.627 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.9 mm -89.67 129.83 39.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.522 -179.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.2 m170 -103.7 94.82 5.65 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -91.09 116.02 28.48 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.371 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -86.56 99.65 11.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.179 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.4 m -104.06 171.48 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.936 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 49.5 tttm -127.41 140.02 52.44 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.491 ' SD ' ' HB2' ' A' ' 77' ' ' PRO . 43.9 tpp -75.55 63.68 1.55 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.226 0.536 . . . . 10.0 110.609 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.9 m -161.42 -40.14 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.676 -0.693 . . . . 10.0 109.663 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.2 163.36 27.14 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.32 -0.854 . . . . 10.0 111.983 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -90.47 153.62 20.25 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.182 -0.917 . . . . 10.0 109.768 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.5 mt -72.72 -10.6 59.99 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.163 -0.215 . . . . 10.0 111.146 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 30.8 tptt -60.36 -47.31 86.63 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.281 -0.637 . . . . 10.0 109.281 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -62.92 -37.2 86.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.144 -0.935 . . . . 10.0 110.486 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -69.14 -45.31 70.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.319 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -60.01 -47.15 87.02 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.222 -0.445 . . . . 10.0 112.063 -179.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -69.27 -37.69 78.02 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 121.051 -0.259 . . . . 10.0 111.584 -178.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.438 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 45.8 m -66.09 -35.65 81.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.852 0.358 . . . . 10.0 111.391 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -66.65 -35.49 80.29 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.484 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 64.5 m -63.86 -35.24 79.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.953 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.438 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 64.2 mt-30 -71.02 -33.71 70.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.178 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.64 -32.99 74.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.599 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -92.15 -29.29 16.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.264 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 97.1 33.08 6.14 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 120.741 -0.742 . . . . 10.0 112.442 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.8 m -128.39 156.96 76.09 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 110.262 -0.273 . . . . 10.0 110.262 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -68.87 156.54 65.08 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.125 1.884 . . . . 10.0 111.197 179.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.484 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 12.1 ttt -67.02 156.43 36.05 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.962 -0.295 . . . . 10.0 110.38 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.4 t30 79.78 -0.27 2.14 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 123.932 0.77 . . . . 10.0 111.697 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 76.0 p -85.89 -27.84 24.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.141 0.496 . . . . 10.0 110.089 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 63.1 mt -112.31 129.83 56.16 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.744 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.468 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.6 ptt-85 -100.86 129.97 46.81 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.798 179.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -96.82 117.86 32.0 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.5 mt -103.66 124.55 49.04 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.336 0.588 . . . . 10.0 111.128 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -127.51 105.38 8.46 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.186 -0.915 . . . . 10.0 109.227 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 65.54 25.13 11.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.459 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.98 -11.37 65.98 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.927 -0.654 . . . . 10.0 112.958 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -101.4 148.62 24.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.782 0.291 . . . . 10.0 110.285 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.401 HH12 ' HD2' ' A' ' 70' ' ' ARG . 9.6 ptm180 -89.3 131.43 35.4 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.99 0.424 . . . . 10.0 110.376 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 45.7 mm -69.89 120.91 18.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.217 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.404 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -85.19 169.19 14.08 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.326 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -72.62 -30.75 64.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.905 0.383 . . . . 10.0 111.237 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 18.1 p-10 -91.23 9.38 31.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.877 0.37 . . . . 10.0 111.146 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 72' ' ' ALA . 1.4 m170 -74.94 148.97 39.56 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.107 0.48 . . . . 10.0 110.765 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.593 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -133.59 145.42 56.22 Favored Pre-proline 0 C--N 1.32 -0.689 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.082 179.33 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.491 ' HB2' ' SD ' ' A' ' 40' ' ' MET . 31.6 Cg_exo -59.04 -13.27 18.3 Favored 'Trans proline' 0 N--CA 1.477 0.522 0 C-N-CA 122.834 2.356 . . . . 10.0 112.991 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -73.7 -27.57 61.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.558 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.593 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.0 pt-20 -98.65 172.45 7.47 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.694 -0.484 . . . . 10.0 109.694 179.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 31.5 mt 72.26 -55.9 0.66 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.685 0.616 . . . . 10.0 110.989 -179.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 121.27 66.42 0.25 Allowed Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 121.076 -0.583 . . . . 10.0 112.377 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 60.6 mtt -96.78 137.4 35.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.555 0.217 . . . . 10.0 110.497 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.465 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 2.4 mm-40 -138.04 -173.04 3.4 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.042 0.449 . . . . 10.0 111.307 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.42 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 24.6 tp10 -73.67 140.58 46.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.001 -0.545 . . . . 10.0 109.909 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 68.25 23.59 7.75 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.604 0.565 . . . . 10.0 110.682 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.5 t0 -72.18 152.53 42.2 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.071 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 41.3 t -107.19 122.66 61.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.439 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.9 tt -126.27 134.34 66.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -103.34 145.92 29.24 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.771 0.32 . . . . 10.0 111.312 -178.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -126.99 125.31 66.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.115 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -130.19 157.31 42.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.608 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -82.97 131.74 35.17 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.101 -0.333 . . . . 10.0 110.101 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.468 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.2 mm-40 -78.92 154.54 29.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.66 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -70.51 -14.83 62.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.96 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.5 p -74.43 -25.42 59.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.759 179.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.84 -9.59 44.02 Favored Glycine 0 C--N 1.332 0.328 0 CA-C-N 115.919 -0.582 . . . . 10.0 112.107 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.799 -1.001 . . . . 10.0 110.928 -179.339 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 7.0 t30 . . . . . 0 N--CA 1.483 1.203 0 CA-C-O 121.07 0.462 . . . . 10.0 110.62 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 57.2 t-20 -118.08 124.71 48.74 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 109.052 -0.722 . . . . 10.0 109.052 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -122.98 128.26 49.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.225 0.536 . . . . 10.0 111.554 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . 0.427 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 18.5 t0 -122.19 130.2 24.8 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 108.376 -0.972 . . . . 10.0 108.376 178.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 59.9 Cg_endo -109.13 127.56 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.115 0 C-N-CA 121.275 1.317 . . . . 10.0 113.904 -179.128 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 2.0 mt -119.96 136.89 55.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 113.815 -1.539 . . . . 10.0 109.192 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 3.1 t -113.95 135.79 52.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-O 121.659 0.742 . . . . 10.0 109.861 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 3.6 tp -113.09 145.0 19.6 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 114.248 -1.342 . . . . 10.0 111.326 -176.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -110.12 129.12 55.75 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.898 -1.046 . . . . 10.0 111.263 -174.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo . . . . . 0 C--O 1.251 1.14 0 C-N-CA 123.133 2.555 . . . . 10.0 111.976 179.316 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 . . . . . 0 N--CA 1.483 1.219 0 CA-C-O 120.468 0.175 . . . . 10.0 110.588 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 38.1 mm -114.1 116.0 51.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.425 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.2 ttpm? -99.95 106.53 18.34 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.986 0.422 . . . . 10.0 110.451 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 31.2 mt -90.99 150.92 21.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.648 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.5 mtpt -107.16 109.68 21.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.283 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.41 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.4 t -92.6 126.59 45.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 179.223 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 27.3 mm -94.8 112.22 26.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.978 0.418 . . . . 10.0 110.992 -179.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.25 160.66 35.03 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.776 -0.647 . . . . 10.0 112.028 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.9 tp60 -63.08 -32.82 74.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.044 0.387 . . . . 10.0 112.044 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -88.9 25.66 1.74 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.777 0.322 . . . . 10.0 111.52 -179.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.6 m 65.66 42.58 3.56 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.251 0.548 . . . . 10.0 111.13 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.6 p -101.82 135.11 43.92 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.276 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -108.49 96.39 6.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.272 0.558 . . . . 10.0 109.495 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.41 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 7.2 mm -79.99 129.67 37.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.682 -0.69 . . . . 10.0 111.261 -178.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -101.32 86.23 2.95 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.624 -0.717 . . . . 10.0 109.654 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.27 117.77 30.47 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.506 -0.478 . . . . 10.0 110.167 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -93.22 104.11 16.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.401 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.4 m -103.54 170.49 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.341 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -123.12 135.72 54.49 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.272 -0.27 . . . . 10.0 110.272 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.53 ' O ' ' HB ' ' A' ' 41' ' ' THR . 62.3 tpp -74.13 76.24 1.76 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.437 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.53 ' HB ' ' O ' ' A' ' 40' ' ' MET . 12.0 t 170.39 -24.86 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.334 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.79 151.95 24.0 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.188 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -74.03 144.27 45.17 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.762 -0.653 . . . . 10.0 110.099 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 58.7 mt -75.0 -4.19 36.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.003 0.43 . . . . 10.0 110.616 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.3 tptt -58.17 -50.86 72.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.627 -0.715 . . . . 10.0 109.549 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -63.21 -39.14 93.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.765 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -62.29 -43.37 98.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.072 -0.513 . . . . 10.0 111.582 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -62.62 -45.39 93.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.29 -0.414 . . . . 10.0 112.082 -179.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -73.52 -35.78 65.63 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.0 -0.28 . . . . 10.0 111.715 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.0 m -64.72 -30.81 71.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.952 0.406 . . . . 10.0 110.807 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -69.14 -36.23 77.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.102 0.477 . . . . 10.0 109.796 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.564 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.3 m -63.5 -37.1 86.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.179 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -63.55 -34.61 78.17 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.399 179.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -69.85 -37.93 76.31 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.573 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -79.88 -18.29 51.04 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.796 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.34 24.62 62.97 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.933 -0.651 . . . . 10.0 112.018 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.4 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 18.3 m -124.93 155.92 69.75 Favored Pre-proline 0 C--N 1.325 -0.46 0 N-CA-C 110.618 -0.142 . . . . 10.0 110.618 -179.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -65.18 154.62 72.62 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.553 2.169 . . . . 10.0 111.993 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.564 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 17.2 ttt -67.5 157.91 33.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.853 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 33.5 t30 79.21 4.16 2.29 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.767 0.827 . . . . 10.0 111.656 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -93.29 -20.61 20.24 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.126 0.489 . . . . 10.0 109.994 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 43.2 mt -116.81 137.81 51.94 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.771 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.486 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 20.1 ptt-85 -107.44 132.04 53.62 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.258 179.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -95.72 115.56 27.6 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.5 mt -105.52 112.5 25.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.065 0.459 . . . . 10.0 110.717 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -117.86 110.63 18.0 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.343 179.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 61.51 28.62 17.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.464 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.18 -21.43 46.05 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.9 -0.667 . . . . 10.0 113.815 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -99.06 150.96 21.47 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 117.269 0.535 . . . . 10.0 111.192 -178.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.429 HH12 ' HD2' ' A' ' 70' ' ' ARG . 11.2 ptm85 -87.09 134.68 33.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.157 0.503 . . . . 10.0 110.565 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.9 mm -75.25 125.48 34.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.998 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.423 ' HB1' ' CD2' ' A' ' 75' ' ' HIS . . . -85.32 168.79 14.36 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.301 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.81 -25.72 59.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.92 0.39 . . . . 10.0 110.872 -179.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -98.08 20.59 12.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.761 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.423 ' CD2' ' HB1' ' A' ' 72' ' ' ALA . 9.5 m170 -88.77 156.97 18.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.729 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.466 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 5.0 p -134.78 154.74 79.58 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.83 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -64.85 -15.01 48.21 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.382 2.055 . . . . 10.0 112.119 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -70.1 -40.37 74.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.817 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.4 pt-20 -85.54 167.9 14.99 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.818 -0.438 . . . . 10.0 109.818 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.1 mt 73.06 -53.04 0.71 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.108 0.563 . . . . 10.0 110.754 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.79 81.41 0.86 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.931 -0.652 . . . . 10.0 112.464 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.2 mtt -109.11 132.0 54.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.685 0.279 . . . . 10.0 110.286 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -128.66 -177.11 4.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.555 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.425 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 21.5 tp10 -74.89 137.03 41.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.446 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 68.89 28.19 5.38 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.675 0.609 . . . . 10.0 111.203 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.82 153.94 30.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.005 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 67.2 t -105.53 132.7 51.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.975 0.416 . . . . 10.0 111.744 -178.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.1 tt -136.95 143.36 35.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.088 -0.708 . . . . 10.0 109.088 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -110.69 149.82 29.92 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.951 0.405 . . . . 10.0 111.472 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.6 p -136.91 132.17 47.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.841 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -139.02 165.32 27.45 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.447 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -80.19 135.97 36.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.232 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.486 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.1 mm-40 -78.49 171.07 15.64 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.861 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -89.17 -5.59 57.61 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.108 0.48 . . . . 10.0 109.855 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.0 p -78.07 -67.76 0.7 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.68 -0.691 . . . . 10.0 111.123 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 130.13 -28.79 3.81 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.001 -0.619 . . . . 10.0 111.93 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.69 -1.061 . . . . 10.0 111.538 179.658 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 42.0 t30 . . . . . 0 N--CA 1.483 1.205 0 CA-C-O 120.962 0.41 . . . . 10.0 110.392 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -122.32 121.38 36.6 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.382 -0.97 . . . . 10.0 108.382 177.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -126.25 128.71 47.62 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.9 0.704 . . . . 10.0 112.9 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . 0.418 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 28.6 t70 -124.18 129.71 24.63 Favored Pre-proline 0 C--N 1.313 -0.989 0 N-CA-C 106.73 -1.581 . . . . 10.0 106.73 175.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 43.6 Cg_endo -109.84 127.92 0.04 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 121.843 1.696 . . . . 10.0 113.959 -178.147 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.9 mt -118.95 135.93 57.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 114.739 -1.119 . . . . 10.0 110.112 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 1.4 t -113.29 135.4 52.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.129 -0.487 . . . . 10.0 109.94 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 6.1 tp -114.06 144.34 21.86 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 114.964 -1.016 . . . . 10.0 110.929 -177.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -110.81 128.96 55.96 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 122.082 0.944 . . . . 10.0 111.378 -175.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo . . . . . 0 C--O 1.246 0.898 0 C-N-CA 122.766 2.311 . . . . 10.0 111.479 179.712 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 110.161 -0.311 . . . . 10.0 110.161 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.5 mm -113.86 125.83 71.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.368 -0.378 . . . . 10.0 109.983 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -96.46 105.16 17.2 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.083 0.468 . . . . 10.0 111.213 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 91.3 mt -90.6 140.85 29.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.905 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.2 mtpt -106.53 116.47 31.98 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.933 0.397 . . . . 10.0 111.135 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.469 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.8 t -101.98 123.84 55.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 37.7 mm -97.78 108.52 21.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.063 0.459 . . . . 10.0 110.832 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.29 170.9 54.31 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.678 -0.692 . . . . 10.0 112.014 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -70.63 -19.17 62.84 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.974 0.416 . . . . 10.0 110.898 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -96.38 21.66 8.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.454 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.3 m 61.97 37.47 14.98 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.476 -0.784 . . . . 10.0 111.136 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 p -90.18 138.93 31.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.126 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.471 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 2.0 mt-10 -104.7 94.05 5.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.095 0.474 . . . . 10.0 110.051 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 19.6 mm -80.84 121.64 34.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.027 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -103.01 88.05 3.07 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.518 -0.549 . . . . 10.0 109.518 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -91.01 114.58 27.14 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.405 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.6 ttmt -86.99 97.99 11.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.046 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.0 m -100.72 172.95 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.621 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 tttt -124.55 135.6 53.29 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.82 -0.437 . . . . 10.0 109.82 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 56.8 tpp -74.61 78.64 1.99 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.891 0.377 . . . . 10.0 111.313 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 7.0 t 174.67 -32.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.336 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.489 ' OG1' ' HB2' ' B' ' 366' ' ' ASP . 0.2 OUTLIER -78.22 148.43 33.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.888 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -72.16 148.96 45.13 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.413 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 80.1 mt -71.22 -6.51 40.19 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.997 0.427 . . . . 10.0 110.463 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.469 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 42.7 tptt -57.38 -52.86 63.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.752 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.446 ' HZ3' ' P ' ' B' ' 365' ' ' SEP . 5.5 tppp? -60.79 -33.82 73.56 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.221 -0.9 . . . . 10.0 111.072 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.63 -44.98 69.54 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.223 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 57.1 mtpt -61.13 -47.01 88.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.982 -178.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 6.5 pt-20 -68.06 -43.07 79.48 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.932 -0.307 . . . . 10.0 111.603 -179.074 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.1 m -62.7 -34.28 76.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.702 0.287 . . . . 10.0 111.199 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -66.6 -38.85 87.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.697 0.284 . . . . 10.0 110.291 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.568 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.5 m -63.47 -41.28 98.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 10.0 109.828 179.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -64.25 -36.61 84.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.328 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.401 HH21 ' CG ' ' B' ' 360' ' ' ASP . 19.8 tpt180 -63.02 -32.08 73.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.847 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -89.63 -31.13 17.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.718 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 106.96 -19.92 34.46 Favored Glycine 0 C--O 1.23 -0.135 0 C-N-CA 121.111 -0.566 . . . . 10.0 112.251 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.0 m -77.29 155.5 81.93 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 110.543 -0.169 . . . . 10.0 110.543 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -62.11 168.03 9.83 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.479 2.12 . . . . 10.0 111.875 179.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.568 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 24.9 ttt -70.46 148.16 48.63 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.785 0.326 . . . . 10.0 111.45 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t30 73.52 6.78 5.09 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.124 -0.944 . . . . 10.0 112.501 178.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.3 p -76.73 -24.85 53.03 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.852 -0.795 . . . . 10.0 108.852 178.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 56.1 mt -115.15 132.24 56.67 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 114.863 -1.062 . . . . 10.0 109.757 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.53 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 13.2 ptt-85 -100.86 129.98 46.8 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.202 -0.453 . . . . 10.0 110.417 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.457 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 64.9 m-85 -91.42 119.1 31.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.018 179.496 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.8 mt -108.98 121.24 44.7 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.539 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -129.96 111.07 12.18 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.652 -0.703 . . . . 10.0 109.627 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 66.57 23.5 10.36 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.214 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.94 -8.23 70.32 Favored Glycine 0 N--CA 1.453 -0.195 0 C-N-CA 121.014 -0.612 . . . . 10.0 113.1 179.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -109.33 144.14 37.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.587 0.232 . . . . 10.0 110.668 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.457 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 11.9 ptm180 -84.01 133.83 34.66 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.173 0.511 . . . . 10.0 110.438 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.1 mm -71.68 125.02 29.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.878 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.02 167.22 19.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.09 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.39 -25.25 59.37 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.162 0.506 . . . . 10.0 110.719 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -96.13 13.74 26.24 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.791 -0.64 . . . . 10.0 111.073 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.9 m170 -85.35 152.52 23.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.149 0.5 . . . . 10.0 111.223 -179.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.501 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 35.4 p -124.43 155.58 68.58 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.95 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -70.94 -10.78 28.27 Favored 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.166 1.911 . . . . 10.0 112.19 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -77.76 -30.1 51.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.386 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.2 pt-20 -92.81 174.69 7.12 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.583 -0.525 . . . . 10.0 109.583 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 4.8 mt 72.89 -56.59 0.66 Allowed 'General case' 0 N--CA 1.469 0.503 0 O-C-N 123.548 0.53 . . . . 10.0 111.017 -179.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 126.16 66.12 0.17 Allowed Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 121.206 -0.521 . . . . 10.0 111.917 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 55.7 mtt -101.85 134.21 45.39 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.738 0.304 . . . . 10.0 110.367 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 0.3 OUTLIER -138.65 178.61 7.02 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.766 -179.848 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.423 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 13.4 tp10 -67.02 143.71 56.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.265 -0.425 . . . . 10.0 109.944 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 22.4 mm-40 70.4 22.24 5.36 Favored 'General case' 0 C--O 1.232 0.169 0 O-C-N 123.716 0.635 . . . . 10.0 111.732 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.454 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.3 OUTLIER -78.89 153.23 30.68 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.352 179.433 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 89.6 t -115.77 128.45 73.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.441 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.9 tt -124.49 144.61 33.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.434 -0.58 . . . . 10.0 109.434 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -105.38 144.84 31.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.849 0.357 . . . . 10.0 110.893 -178.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 9.8 p -135.81 129.86 48.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.987 0.422 . . . . 10.0 110.226 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -135.54 167.69 20.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.508 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -83.18 134.1 34.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.714 0.293 . . . . 10.0 111.145 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.53 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 3.0 mm-40 -74.14 152.42 39.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.396 179.491 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -70.3 -17.16 63.08 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.774 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.2 p -77.08 -25.12 51.97 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.191 0.519 . . . . 10.0 110.639 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.25 -3.81 86.59 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.933 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.822 -0.988 . . . . 10.0 111.295 -179.732 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 65.9 t30 . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 121.014 0.435 . . . . 10.0 110.595 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . 0.444 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 54.1 t30 -121.77 122.24 39.05 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.532 -0.914 . . . . 10.0 108.532 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . 0.471 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 23.2 ptt180 -126.0 128.7 47.87 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 119.791 -0.764 . . . . 10.0 112.035 179.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . 0.401 ' CG ' HH21 ' A' ' 54' ' ' ARG . 28.2 t70 -120.8 130.87 24.65 Favored Pre-proline 0 C--N 1.316 -0.864 0 N-CA-C 106.8 -1.556 . . . . 10.0 106.8 177.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -108.07 128.61 0.05 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.524 0 C-N-CA 121.481 1.454 . . . . 10.0 113.179 -178.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.2 mt -119.27 136.99 54.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 114.128 -1.396 . . . . 10.0 109.734 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 48.7 t -113.25 135.21 53.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.269 0.557 . . . . 10.0 109.59 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 7.1 tp -112.96 144.01 21.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 114.854 -1.067 . . . . 10.0 110.594 -177.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . 0.446 ' P ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . 0.489 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 1.1 t70 -113.28 129.19 56.59 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.396 -1.274 . . . . 10.0 110.568 -176.346 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo . . . . . 0 C--O 1.246 0.891 0 C-N-CA 122.598 2.198 . . . . 10.0 111.396 179.77 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.5 mm -113.02 124.43 69.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 110.002 -0.37 . . . . 10.0 110.002 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -102.38 112.98 25.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.032 0.444 . . . . 10.0 110.385 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.1 mt -98.07 135.49 39.68 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.307 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -95.34 113.45 25.12 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.671 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.538 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.5 t -96.41 128.42 47.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.745 -0.662 . . . . 10.0 109.584 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.3 mm -101.54 109.49 25.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 120.838 0.352 . . . . 10.0 110.747 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -76.74 174.09 54.27 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 121.027 -0.606 . . . . 10.0 112.626 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 13.8 tp60 -69.92 -29.91 67.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.81 0.338 . . . . 10.0 111.662 -179.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -104.96 40.6 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.062 0.458 . . . . 10.0 111.17 -179.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.7 m 57.9 36.0 25.87 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.692 -0.686 . . . . 10.0 111.328 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.65 94.42 9.85 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.691 -0.686 . . . . 10.0 109.929 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.64 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 20.6 mt-10 -78.64 104.9 9.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.086 0.47 . . . . 10.0 109.784 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.422 HG21 HD13 ' A' ' 34' ' ' ILE . 4.1 mm -95.57 136.79 25.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.28 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 45.9 m-70 -110.97 95.33 5.48 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.512 -0.551 . . . . 10.0 109.512 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.04 121.28 34.22 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.356 -0.383 . . . . 10.0 110.499 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -89.17 107.4 19.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.809 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.4 m -110.27 171.05 3.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.969 0.414 . . . . 10.0 110.94 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 75.4 tttt -122.33 140.56 52.52 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.516 ' O ' ' HB ' ' A' ' 41' ' ' THR . 51.6 tpp -74.94 74.9 2.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.745 0.307 . . . . 10.0 111.449 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 40' ' ' MET . 14.5 t 169.82 -24.91 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.559 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -75.99 149.6 37.58 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.887 0.375 . . . . 10.0 110.934 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 25.4 m170 -78.36 138.31 38.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.003 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.1 mt -65.69 -16.17 63.5 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.528 -0.305 . . . . 10.0 111.46 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.435 ' HD2' ' HB3' ' A' ' 73' ' ' ASP . 34.7 tttp -60.31 -42.9 96.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.012 0.434 . . . . 10.0 109.91 178.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.511 ' HZ3' ' P ' ' B' ' 365' ' ' SEP . 4.9 tppp? -65.58 -30.72 71.49 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.034 179.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.409 HD11 ' HA ' ' A' ' 47' ' ' LEU . 4.4 mm? -74.56 -49.13 23.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.626 -0.715 . . . . 10.0 111.094 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -56.61 -46.8 80.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.567 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -65.21 -40.37 94.05 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.282 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 65.9 m -67.41 -34.66 77.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.311 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -63.37 -40.84 98.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.995 0.426 . . . . 10.0 109.869 179.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 39.0 m -62.73 -42.21 99.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.767 179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -64.76 -30.41 71.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.646 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -72.52 -45.15 60.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.033 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -76.56 -14.12 60.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.409 -0.36 . . . . 10.0 111.01 -179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.71 37.17 17.41 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.864 -0.684 . . . . 10.0 112.178 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.6 m -130.42 155.4 81.08 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-O 120.511 0.196 . . . . 10.0 110.547 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -66.22 163.95 29.82 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 122.176 1.917 . . . . 10.0 111.92 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 12.1 tpt -70.62 150.68 45.78 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 110.065 -0.346 . . . . 10.0 110.065 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.0 t30 73.75 5.99 4.9 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.105 0.562 . . . . 10.0 112.166 179.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 80.4 p -84.0 -23.29 31.05 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.145 0.497 . . . . 10.0 110.351 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 43.7 mt -121.21 147.21 45.92 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.428 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.435 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 18.0 ptt-85 -116.9 134.24 55.01 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.243 -0.435 . . . . 10.0 109.963 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.403 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 86.0 m-85 -95.9 128.29 42.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.091 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 90.7 mt -112.23 125.89 54.64 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.229 0.538 . . . . 10.0 111.369 -179.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -137.59 118.51 14.25 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.537 -0.912 . . . . 10.0 108.537 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 66.23 19.6 11.07 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.218 0.532 . . . . 10.0 110.494 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.16 -4.84 84.61 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.221 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -105.39 145.46 30.77 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.189 -0.3 . . . . 10.0 110.189 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.403 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 12.1 ptm180 -85.0 125.76 32.98 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.089 0.471 . . . . 10.0 110.214 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 43.6 mm -63.98 123.58 17.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.313 -0.858 . . . . 10.0 111.52 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.07 166.22 15.19 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.203 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.435 ' HB3' ' HD2' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -73.89 -19.15 60.79 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.995 0.426 . . . . 10.0 111.378 -179.389 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -97.06 17.22 17.53 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.117 -0.492 . . . . 10.0 111.045 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -99.94 153.03 19.5 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.051 0.453 . . . . 10.0 111.129 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.409 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 57.5 p -131.63 162.82 53.9 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 108.961 -0.755 . . . . 10.0 108.961 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -69.99 -5.91 17.47 Favored 'Trans proline' 0 CA--C 1.53 0.317 0 C-N-CA 122.33 2.02 . . . . 10.0 112.16 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.64 -30.38 61.61 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.683 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.472 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 1.4 pt-20 -101.38 171.56 7.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.162 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 7.5 mt 73.26 -49.0 0.69 Allowed 'General case' 0 N--CA 1.469 0.498 0 O-C-N 123.699 0.624 . . . . 10.0 111.285 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 113.53 76.27 0.73 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.83 -0.7 . . . . 10.0 112.443 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 58.1 mtt -105.76 122.46 46.12 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.837 0.351 . . . . 10.0 110.265 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.523 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 5.4 mm-40 -120.97 -178.75 3.82 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.949 -179.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -70.74 144.03 51.06 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 67.04 23.54 9.7 Favored 'General case' 0 N--CA 1.462 0.171 0 O-C-N 123.523 0.514 . . . . 10.0 110.904 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.523 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.8 OUTLIER -75.6 148.51 38.75 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.862 -0.421 . . . . 10.0 109.862 179.788 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 94.8 t -107.13 119.57 56.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.038 0.447 . . . . 10.0 111.446 -178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.538 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 15.6 tt -118.49 136.36 55.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -103.07 150.65 23.39 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.84 0.352 . . . . 10.0 110.975 -178.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.6 p -136.43 131.43 48.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.012 179.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -135.02 159.87 40.14 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.411 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -73.49 136.92 44.2 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.505 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.435 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 1.3 mm-40 -73.5 159.62 32.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.697 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -72.98 -24.79 60.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.191 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.8 p -78.28 -34.27 49.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.214 0.53 . . . . 10.0 110.899 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.31 12.92 77.84 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.925 -0.87 . . . . 10.0 110.925 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.947 0 CA-C-O 118.876 -0.958 . . . . 10.0 111.283 -179.642 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 . . . . . 0 N--CA 1.48 1.025 0 CA-C-O 121.347 0.594 . . . . 10.0 110.168 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . 0.64 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 2.5 m-20 -120.17 125.88 49.3 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 108.454 -0.943 . . . . 10.0 108.454 179.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 22.3 ptt180 -125.84 122.05 35.02 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 119.378 -0.929 . . . . 10.0 113.019 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -128.46 127.27 23.64 Favored Pre-proline 0 C--N 1.316 -0.888 0 N-CA-C 107.536 -1.283 . . . . 10.0 107.536 174.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -110.78 126.34 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.154 0 C-N-CA 121.66 1.573 . . . . 10.0 113.086 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.7 mt -120.27 135.56 60.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.027 -0.988 . . . . 10.0 109.707 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 21.6 t -113.19 135.74 51.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.47 0.652 . . . . 10.0 109.721 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 7.8 tp -113.27 147.9 16.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 114.836 -1.075 . . . . 10.0 112.107 -176.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . 0.511 ' P ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -113.7 131.92 55.99 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.301 -0.863 . . . . 10.0 112.367 -174.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_endo . . . . . 0 C--O 1.248 1.011 0 C-N-CA 123.132 2.554 . . . . 10.0 112.293 179.547 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 . . . . . 0 N--CA 1.478 0.95 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.1 mm -118.55 113.4 41.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.762 -0.459 . . . . 10.0 109.762 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.51 ' HB3' ' HZ3' ' A' ' 23' ' ' LYS . 2.6 ttpm? -96.7 111.61 23.7 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.236 -0.438 . . . . 10.0 109.9 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 30.1 mt -94.03 150.87 19.95 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.4 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 38.0 mtpt -110.31 107.53 17.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.284 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.443 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 3.2 t -89.08 126.21 42.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.598 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.9 mm -93.54 115.87 33.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 120.984 0.421 . . . . 10.0 111.188 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.59 147.1 19.75 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 111.256 -0.738 . . . . 10.0 111.256 178.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -64.47 -21.14 66.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.778 0.323 . . . . 10.0 111.811 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -95.45 28.21 3.03 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 120.857 0.36 . . . . 10.0 111.021 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.1 m 61.0 66.42 0.9 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.588 0.708 . . . . 10.0 110.919 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.2 p -136.59 144.85 44.34 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.096 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -118.57 103.86 10.12 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.443 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 5.5 mm -88.77 119.74 36.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.197 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -96.93 96.53 8.58 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -97.3 112.86 24.49 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.398 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -86.73 103.13 14.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.977 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -108.31 173.13 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.816 0.341 . . . . 10.0 110.675 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.414 ' HD2' ' CG2' ' A' ' 41' ' ' THR . 23.4 ttmt -121.9 137.79 54.65 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.298 -0.63 . . . . 10.0 109.298 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.432 ' O ' ' HB ' ' A' ' 41' ' ' THR . 61.9 tpp -73.94 78.9 1.65 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.957 0.408 . . . . 10.0 110.598 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.432 ' HB ' ' O ' ' A' ' 40' ' ' MET . 15.3 t 174.09 -26.33 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.444 -0.798 . . . . 10.0 110.081 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.31 151.88 26.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.417 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.405 ' ND1' ' HB3' ' A' ' 45' ' ' LYS . 6.3 p80 -76.87 145.55 38.26 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.097 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.5 mt -71.83 -8.97 57.47 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.588 -0.278 . . . . 10.0 111.285 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.405 ' HB3' ' ND1' ' A' ' 43' ' ' HIS . 47.3 tptt -59.47 -48.2 82.57 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.061 0.458 . . . . 10.0 110.007 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.429 ' HZ1' ' P ' ' B' ' 367' ' ' SEP . 5.4 tppp? -62.85 -33.94 76.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.309 -0.859 . . . . 10.0 110.715 179.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.98 -44.24 63.83 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.286 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -61.63 -42.6 99.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.297 -0.41 . . . . 10.0 111.399 -179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -72.34 -39.83 67.84 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 121.001 -0.28 . . . . 10.0 111.289 -179.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.425 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 66.4 m -63.45 -35.77 81.53 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.75 0.31 . . . . 10.0 111.411 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -64.32 -41.46 96.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.799 0.333 . . . . 10.0 110.177 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 57.2 m -62.3 -38.23 88.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.348 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.425 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.4 mt-30 -65.9 -42.9 89.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.79 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -61.75 -35.67 78.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.417 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -83.22 -16.82 45.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.849 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.31 35.58 42.25 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.094 -0.574 . . . . 10.0 112.535 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.3 m -131.37 155.55 81.34 Favored Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 110.24 -0.282 . . . . 10.0 110.24 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.34 159.57 39.18 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.358 2.039 . . . . 10.0 111.769 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 16.0 ttt -71.01 155.95 40.21 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 121.225 -0.19 . . . . 10.0 110.702 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 32.8 t30 76.65 -7.38 1.85 Allowed 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.542 0.737 . . . . 10.0 111.981 179.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.5 p -75.79 -19.45 58.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.226 0.536 . . . . 10.0 110.276 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.3 mt -116.97 135.27 53.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.253 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.432 ' HD3' ' OE2' ' A' ' 93' ' ' GLU . 7.1 ptt180 -111.34 119.96 40.61 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.145 0.498 . . . . 10.0 110.432 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -88.22 124.92 34.33 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.889 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 34.2 mt -114.5 124.86 52.97 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.044 0.449 . . . . 10.0 110.974 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -135.17 119.88 18.3 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.281 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 64.78 20.57 12.17 Favored 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.433 0.458 . . . . 10.0 111.136 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.71 2.45 81.75 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.912 -0.661 . . . . 10.0 112.302 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -114.76 145.06 42.52 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.749 -0.463 . . . . 10.0 109.749 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -80.98 142.19 33.69 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.975 0.417 . . . . 10.0 109.901 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.2 mm -79.28 121.17 31.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.427 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.7 169.47 18.18 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.505 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -81.71 -18.27 44.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.808 0.337 . . . . 10.0 111.085 -179.06 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -101.86 0.96 36.44 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.781 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 18.4 m170 -71.53 159.13 35.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.936 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.6 p -134.57 160.71 67.42 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.826 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -67.12 -14.66 44.15 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.454 2.103 . . . . 10.0 112.249 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -69.28 -46.41 67.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.527 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -82.79 172.91 12.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.147 -0.478 . . . . 10.0 109.839 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.0 mt 73.45 -46.56 0.64 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.164 0.586 . . . . 10.0 111.047 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 110.9 63.48 0.5 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 121.185 -0.531 . . . . 10.0 112.68 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 43.5 mtt -101.68 128.45 47.99 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.844 0.354 . . . . 10.0 110.711 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 2.8 mm-40 -132.56 -174.39 3.44 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.63 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.4 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 42.5 tp10 -66.28 138.33 57.57 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.183 -179.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 66.27 26.3 10.39 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 123.727 0.642 . . . . 10.0 111.9 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.4 OUTLIER -76.3 141.52 41.59 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.851 -0.426 . . . . 10.0 109.851 179.04 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 59.6 t -96.36 120.26 45.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.504 -178.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 15.3 tt -128.8 138.16 55.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.646 -0.707 . . . . 10.0 109.193 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -112.74 149.7 32.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.97 0.414 . . . . 10.0 111.462 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.4 p -130.96 133.86 62.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.184 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -124.84 168.77 12.79 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.985 -0.552 . . . . 10.0 109.577 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -83.08 138.76 33.57 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.362 -0.607 . . . . 10.0 109.362 178.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.432 ' OE2' ' HD3' ' A' ' 63' ' ' ARG . 2.8 mm-40 -74.67 170.41 15.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.197 0.522 . . . . 10.0 111.139 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -82.87 -28.87 29.75 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.483 -0.78 . . . . 10.0 109.687 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -74.35 -55.15 6.33 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.603 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 104.4 11.87 30.26 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.608 -0.806 . . . . 10.0 112.835 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.794 0 CA-C-O 118.891 -0.949 . . . . 10.0 111.913 179.548 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 121.22 0.534 . . . . 10.0 110.869 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 63.0 t-20 -121.16 124.09 43.88 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.458 -0.571 . . . . 10.0 109.458 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 33.2 ptt180 -123.3 126.08 46.24 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.286 0.565 . . . . 10.0 112.507 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -125.33 128.68 24.68 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 108.263 -1.014 . . . . 10.0 108.263 176.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -111.02 128.0 0.03 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 121.851 1.7 . . . . 10.0 113.52 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . 0.417 HD12 HG21 ' B' ' 362' ' ' ILE . 6.1 mt -120.51 137.26 54.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 114.807 -1.088 . . . . 10.0 109.965 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 37.7 t -112.54 134.57 54.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.309 -0.626 . . . . 10.0 109.309 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 7.6 tp -113.91 145.42 19.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 114.809 -1.087 . . . . 10.0 111.514 -176.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.95 129.91 56.02 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 114.954 -1.021 . . . . 10.0 111.204 -175.144 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . 0.429 ' P ' ' HZ1' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo . . . . . 0 C--O 1.246 0.883 0 C-N-CA 122.809 2.34 . . . . 10.0 112.404 179.679 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 N--CA 1.475 0.822 0 CA-C-O 120.782 0.325 . . . . 10.0 110.436 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 18.1 mm -106.3 123.18 60.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.499 -0.556 . . . . 10.0 109.499 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.464 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 4.5 ttpm? -96.47 108.12 20.63 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.183 0.516 . . . . 10.0 110.691 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.8 mt -93.36 137.37 32.73 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.844 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -99.87 106.97 18.86 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.116 0.484 . . . . 10.0 110.819 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.0 t -89.41 130.15 39.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.293 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 41.7 mm -91.01 111.59 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.905 0.383 . . . . 10.0 110.779 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -77.37 157.86 46.8 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.689 -0.687 . . . . 10.0 112.235 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 12.6 tp60 -58.52 -32.24 68.65 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -97.07 29.16 3.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.775 0.321 . . . . 10.0 111.387 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 m 64.52 35.4 9.38 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.351 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.23 136.98 32.72 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.725 -0.67 . . . . 10.0 110.101 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -100.16 101.04 11.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.891 0.376 . . . . 10.0 110.344 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.418 HG22 HD12 ' A' ' 34' ' ' ILE . 0.7 OUTLIER -88.61 120.61 37.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.268 -0.423 . . . . 10.0 109.94 -179.867 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -100.18 98.62 9.3 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -99.98 118.63 36.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.143 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.4 ttmt -91.9 103.49 16.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.241 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 5.0 m -100.2 171.36 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.24 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -121.53 141.73 50.77 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.225 -0.443 . . . . 10.0 109.976 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 57.8 tpp -81.08 73.05 8.13 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.016 0.436 . . . . 10.0 111.032 -179.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.9 t 175.95 -26.16 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.192 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.57 147.36 25.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.254 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 29.8 m80 -75.52 148.8 38.67 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.242 -0.281 . . . . 10.0 110.242 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.7 mt -67.66 -10.53 53.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.813 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.543 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 51.2 tptt -57.77 -43.85 85.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.766 -0.652 . . . . 10.0 109.738 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -67.4 -32.21 72.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.395 -0.821 . . . . 10.0 110.956 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -74.05 -42.92 59.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.542 -178.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -59.76 -48.37 81.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.939 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 20.0 pt-20 -67.7 -37.81 82.77 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.864 0.32 . . . . 10.0 111.864 -178.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.6 m -68.34 -32.6 72.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.695 0.283 . . . . 10.0 111.463 -179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 50.1 t80 -66.87 -39.05 87.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.893 0.377 . . . . 10.0 110.224 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.516 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 81.2 m -62.17 -36.72 82.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.41 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -65.14 -35.96 82.76 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.121 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -64.8 -36.16 83.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.69 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -92.24 -6.92 49.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.394 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 69.58 36.81 77.08 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.917 -0.658 . . . . 10.0 112.43 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.495 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 17.6 m -126.0 155.21 73.59 Favored Pre-proline 0 C--N 1.323 -0.583 0 N-CA-C 110.133 -0.321 . . . . 10.0 110.133 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -68.85 157.85 60.2 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.126 1.884 . . . . 10.0 111.588 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.516 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 9.4 ttt -69.72 154.74 41.56 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.036 -0.265 . . . . 10.0 110.344 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.3 t30 77.35 -3.59 2.43 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 123.939 0.775 . . . . 10.0 111.575 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 87.5 p -83.84 -19.0 35.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.204 0.526 . . . . 10.0 109.71 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 82.6 mt -117.02 126.13 52.41 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.268 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.466 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.8 ptt-85 -100.0 121.86 42.02 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.095 0.474 . . . . 10.0 109.858 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -89.99 111.9 23.13 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.8 mt -99.61 113.3 25.64 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.227 -178.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -113.82 101.61 9.45 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.375 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 60.57 38.37 18.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.026 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.07 -34.0 4.79 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.852 -0.613 . . . . 10.0 113.045 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -83.7 135.04 34.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.716 0.294 . . . . 10.0 110.819 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -83.46 131.81 35.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.979 0.419 . . . . 10.0 110.416 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 48.3 mm -68.27 120.64 16.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.824 -0.625 . . . . 10.0 111.583 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.14 177.67 8.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.278 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.543 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 0.8 OUTLIER -83.86 -14.02 52.22 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.552 -0.294 . . . . 10.0 111.504 -179.074 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.4 p-10 -108.89 9.88 26.57 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.679 -0.237 . . . . 10.0 111.391 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 3.1 m170 -78.56 157.36 28.81 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.957 0.408 . . . . 10.0 111.265 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.527 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.8 OUTLIER -136.54 154.0 76.46 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.64 179.521 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -66.42 -11.0 29.71 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.741 2.294 . . . . 10.0 112.745 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -74.62 -24.34 58.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.32 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.5 pt-20 -107.18 -179.01 3.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.123 -0.49 . . . . 10.0 109.713 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 6.1 mt 71.21 -62.76 0.44 Allowed 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.762 0.664 . . . . 10.0 111.113 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 130.59 59.89 0.1 OUTLIER Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 111.654 -0.578 . . . . 10.0 111.654 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 53.6 mtt -97.38 125.93 42.31 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.75 0.31 . . . . 10.0 110.827 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.6 mm-40 -127.64 -175.39 3.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.878 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.464 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 15.3 tp10 -71.38 138.11 48.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.445 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 64.64 34.34 9.87 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 123.565 0.54 . . . . 10.0 110.723 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.0 OUTLIER -79.53 147.69 32.07 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.24 179.683 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.4 t -103.17 124.64 57.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.987 0.423 . . . . 10.0 111.585 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.4 tt -131.95 147.15 32.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.985 -0.552 . . . . 10.0 109.723 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -107.41 151.55 25.38 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.871 0.367 . . . . 10.0 111.381 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.8 p -135.83 125.83 41.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.887 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -133.18 160.59 36.79 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.73 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.78 133.79 35.14 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.398 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.466 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.9 mm-40 -76.47 150.61 36.65 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.724 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -68.14 -21.68 64.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.939 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.8 p -76.97 -15.05 59.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.949 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.29 5.32 66.42 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 121.105 -0.569 . . . . 10.0 112.296 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.876 0 CA-C-O 118.719 -1.045 . . . . 10.0 111.097 -179.426 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 54.7 t30 . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.655 0.264 . . . . 10.0 111.28 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -122.03 120.03 33.16 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.04 -1.096 . . . . 10.0 108.04 177.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -129.59 129.79 44.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.179 0.514 . . . . 10.0 112.131 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . 0.431 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 27.1 t0 -121.59 128.09 25.78 Favored Pre-proline 0 C--N 1.308 -1.218 0 N-CA-C 107.06 -1.459 . . . . 10.0 107.06 175.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 77.7 Cg_endo -108.86 128.48 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 121.89 1.726 . . . . 10.0 113.695 -178.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.3 mt -120.64 134.6 63.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 114.549 -1.205 . . . . 10.0 110.171 179.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 6.0 t -115.08 135.61 54.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 109.08 -0.711 . . . . 10.0 109.08 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 7.2 tp -114.57 146.06 19.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.503 -0.771 . . . . 10.0 112.423 -176.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -111.2 131.67 54.94 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.468 -0.787 . . . . 10.0 112.529 -174.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . 0.415 ' HA ' ' HD3' ' B' ' 368' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' B' ' 367' ' ' SEP . 25.0 Cg_exo . . . . . 0 C--O 1.247 0.948 0 C-N-CA 122.916 2.411 . . . . 10.0 111.729 178.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 110.063 -0.347 . . . . 10.0 110.063 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.2 mm -111.49 113.23 43.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.325 -0.398 . . . . 10.0 109.962 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.503 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.9 OUTLIER -96.05 109.48 21.89 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.312 0.577 . . . . 10.0 110.282 179.629 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 67.1 mt -95.67 144.01 26.45 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.039 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.5 mtpt -104.43 109.67 21.63 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.896 0.379 . . . . 10.0 110.548 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.409 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.3 t -90.37 128.9 41.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.93 -0.577 . . . . 10.0 109.517 179.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.5 mm -87.98 109.49 19.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.369 -0.378 . . . . 10.0 111.349 -179.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.01 160.29 40.55 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.79 -0.719 . . . . 10.0 111.365 178.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -62.72 -35.84 81.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.89 0.345 . . . . 10.0 111.47 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 17.0 p-10 -88.88 27.94 1.25 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.935 0.397 . . . . 10.0 111.235 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.9 m 61.38 30.54 19.03 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.575 -0.739 . . . . 10.0 111.442 179.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.3 p -82.49 133.31 35.2 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.524 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.529 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 37.0 mt-10 -95.82 96.34 8.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.175 0.512 . . . . 10.0 110.231 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.409 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 2.1 mm -85.68 115.91 27.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.294 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.3 m170 -95.69 96.99 9.37 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.796 -0.446 . . . . 10.0 109.796 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.47 114.46 26.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.641 -179.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -91.25 105.87 18.1 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.195 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.9 m -111.41 170.5 3.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.684 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -117.21 149.31 40.62 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.877 -0.416 . . . . 10.0 109.877 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 60.4 tpp -78.27 69.64 4.51 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.557 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.497 HG23 ' OD2' ' B' ' 366' ' ' ASP . 0.4 OUTLIER 173.87 -29.85 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.587 179.189 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.8 137.64 52.01 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.0 m80 -70.84 138.51 50.34 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.093 -0.503 . . . . 10.0 109.889 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.9 mt -66.8 -7.63 22.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.495 -0.32 . . . . 10.0 111.758 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -57.94 -49.63 76.11 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.6 ttpt -70.3 -34.24 72.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.44 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -65.17 -44.65 87.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.86 0.362 . . . . 10.0 110.836 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -60.26 -44.63 95.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.967 -0.56 . . . . 10.0 111.66 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.484 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 17.9 pt-20 -74.53 -34.99 63.13 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.697 -0.401 . . . . 10.0 111.221 -179.403 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.508 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 67.6 m -60.25 -37.36 80.17 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-O 121.072 0.463 . . . . 10.0 110.347 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -64.3 -40.83 96.72 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.562 -0.533 . . . . 10.0 109.562 178.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 56.7 m -63.93 -39.23 93.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.477 -0.783 . . . . 10.0 110.079 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.508 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 60.4 mt-30 -66.06 -36.06 82.2 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.046 179.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.406 HH21 ' CG ' ' B' ' 360' ' ' ASP . 6.4 tpt180 -67.64 -37.77 82.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.672 -0.694 . . . . 10.0 110.774 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -80.79 -29.5 36.09 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.999 0.428 . . . . 10.0 110.797 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 96.26 31.06 7.41 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.831 -0.7 . . . . 10.0 112.242 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.9 m -129.8 155.62 80.18 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 110.182 -0.303 . . . . 10.0 110.182 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -67.25 157.74 60.31 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.375 2.05 . . . . 10.0 111.511 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 10.6 ttt -67.0 156.4 36.1 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.892 -0.323 . . . . 10.0 111.116 -179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.3 t30 79.06 -8.5 1.63 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.876 0.87 . . . . 10.0 111.953 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 82.8 p -75.75 -23.7 56.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.244 0.545 . . . . 10.0 109.949 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 50.2 mt -116.0 141.33 48.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.482 -0.781 . . . . 10.0 109.981 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.42 HH12 ' HD3' ' A' ' 63' ' ' ARG . 12.7 ptt180 -113.13 129.19 56.59 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.988 0.423 . . . . 10.0 110.11 179.153 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -95.99 124.79 40.14 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.825 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.1 mt -115.29 126.16 54.15 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.159 0.505 . . . . 10.0 110.926 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -124.88 100.35 6.56 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.246 -0.888 . . . . 10.0 109.058 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 64.98 33.82 9.43 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.066 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.24 -14.42 62.38 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 115.725 -0.671 . . . . 10.0 113.24 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -97.02 136.0 38.21 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.833 -0.432 . . . . 10.0 109.833 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -83.86 140.03 32.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.096 0.474 . . . . 10.0 110.66 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 50.0 mm -77.35 118.3 23.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.728 -0.669 . . . . 10.0 111.083 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.57 160.32 21.45 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.51 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -64.84 -25.84 68.08 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.378 -0.374 . . . . 10.0 111.5 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -95.59 7.12 47.18 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.431 -0.35 . . . . 10.0 111.659 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 3.6 m170 -78.3 150.26 33.35 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.221 0.534 . . . . 10.0 111.412 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.574 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -132.34 148.66 70.59 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.578 -0.737 . . . . 10.0 110.101 179.254 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -60.38 -17.23 46.16 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.695 2.263 . . . . 10.0 112.569 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -67.01 -33.89 76.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.778 -0.647 . . . . 10.0 110.474 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.4 pt-20 -96.8 173.77 7.14 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.316 -0.402 . . . . 10.0 109.918 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.412 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 87.6 mt 72.34 -59.15 0.57 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.456 0.703 . . . . 10.0 110.512 -178.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 120.78 87.07 0.95 Allowed Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 121.211 -0.518 . . . . 10.0 111.96 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 62.4 mtt -117.61 132.73 56.46 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.611 0.243 . . . . 10.0 110.415 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -126.67 179.2 5.46 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.817 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.503 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 17.2 tp10 -69.89 137.18 51.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.071 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 5.4 mm-40 71.93 20.38 4.45 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 123.748 0.655 . . . . 10.0 111.591 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.13 147.17 38.73 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.887 -0.325 . . . . 10.0 110.278 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.9 t -99.02 133.71 40.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.88 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.7 tt -134.99 144.13 35.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 178.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -105.92 155.19 19.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.135 0.493 . . . . 10.0 111.997 -178.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.9 p -139.87 127.19 24.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.458 -0.792 . . . . 10.0 109.326 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -133.64 157.89 44.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.606 -0.27 . . . . 10.0 110.391 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -74.6 133.75 42.16 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.14 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.49 ' OE1' ' HA ' ' A' ' 93' ' ' GLU . 3.9 mm-40 -75.69 155.08 36.05 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.754 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -71.78 -24.99 61.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.46 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.2 p -66.92 -39.25 87.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.149 0.499 . . . . 10.0 110.498 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.44 0.9 75.58 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.768 -0.73 . . . . 10.0 112.195 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.825 -0.986 . . . . 10.0 111.295 -179.983 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 121.2 0.524 . . . . 10.0 110.864 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . 0.529 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 52.3 t30 -116.74 124.39 49.51 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 108.904 -0.776 . . . . 10.0 108.904 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 16.5 ptt180 -124.69 128.26 48.55 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.45 0.643 . . . . 10.0 111.277 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . 0.406 ' CG ' HH21 ' A' ' 54' ' ' ARG . 27.8 t0 -120.51 130.37 24.88 Favored Pre-proline 0 C--N 1.314 -0.936 0 N-CA-C 106.631 -1.618 . . . . 10.0 106.631 177.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -108.23 129.26 0.05 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.331 0 C-N-CA 121.728 1.618 . . . . 10.0 113.317 -178.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.8 mt -116.39 131.8 67.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.379 -1.282 . . . . 10.0 109.352 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 25.9 t -114.96 131.55 66.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.675 0.75 . . . . 10.0 109.43 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 7.0 tp -115.49 145.34 21.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-N 114.126 -1.397 . . . . 10.0 110.683 -177.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . 0.497 ' OD2' HG23 ' A' ' 41' ' ' THR . 11.5 t70 -108.23 129.16 55.21 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.827 0.822 . . . . 10.0 111.258 -174.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . 0.43 ' HD3' ' O ' ' B' ' 366' ' ' ASP . 14.8 Cg_exo . . . . . 0 C--O 1.247 0.928 0 C-N-CA 122.153 1.902 . . . . 10.0 110.992 178.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 . . . . . 0 N--CA 1.478 0.933 0 N-CA-C 110.111 -0.329 . . . . 10.0 110.111 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.8 mm -96.08 113.78 31.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 109.78 -0.452 . . . . 10.0 109.78 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.524 ' HB3' ' HZ3' ' A' ' 23' ' ' LYS . 6.2 ttpm? -98.2 115.22 27.89 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.737 0.303 . . . . 10.0 110.497 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 31.1 mt -100.92 145.51 28.55 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.526 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.418 ' HG2' ' CD2' ' A' ' 35' ' ' HIS . 42.0 mtpt -106.58 102.77 12.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.475 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.9 t -87.37 130.67 36.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 109.541 -0.54 . . . . 10.0 109.541 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.8 mm -102.41 114.61 42.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.893 0.378 . . . . 10.0 110.438 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.17 175.38 54.65 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.801 -0.636 . . . . 10.0 112.705 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.7 tp60 -61.42 -29.5 69.98 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 122.57 0.348 . . . . 10.0 111.66 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -97.64 18.97 14.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.817 0.342 . . . . 10.0 110.581 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.3 m 70.37 24.36 4.71 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.469 -0.787 . . . . 10.0 111.893 179.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 p -72.25 137.38 46.76 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.835 -0.432 . . . . 10.0 109.835 179.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.479 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 16.7 mt-10 -100.4 107.08 18.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.182 0.515 . . . . 10.0 110.296 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.6 mm -97.38 118.93 44.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.384 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.418 ' CD2' ' HG2' ' A' ' 25' ' ' LYS . 41.9 m80 -96.35 96.21 8.59 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.994 0.426 . . . . 10.0 110.061 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.4 116.18 28.44 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.311 -0.404 . . . . 10.0 109.939 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -87.32 103.37 15.41 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.09 -0.505 . . . . 10.0 109.859 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 m -108.76 169.88 3.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.043 0.449 . . . . 10.0 111.743 -178.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -117.79 143.41 46.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.096 -0.502 . . . . 10.0 109.836 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 54.3 tpp -78.23 65.26 3.54 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.372 0.606 . . . . 10.0 110.199 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 78.6 m -164.04 -46.81 0.03 OUTLIER 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.617 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.541 ' OG1' ' HB2' ' B' ' 366' ' ' ASP . 0.3 OUTLIER -68.29 147.17 52.56 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.427 -0.806 . . . . 10.0 111.611 -179.319 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 43.6 m80 -75.31 151.89 38.24 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.659 -0.496 . . . . 10.0 109.659 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.7 mt -70.95 -10.74 60.23 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.455 -0.339 . . . . 10.0 111.492 -179.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.583 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 41.8 tttp -63.06 -47.91 80.95 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.978 -0.379 . . . . 10.0 109.978 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.404 ' HZ2' ' P ' ' B' ' 367' ' ' SEP . 4.6 tppp? -56.28 -40.61 74.54 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.948 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.03 -40.67 96.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.781 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -66.75 -47.25 72.84 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.923 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -69.81 -36.11 75.36 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.045 0.387 . . . . 10.0 112.045 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 49.4 m -75.59 -29.98 59.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.628 0.251 . . . . 10.0 111.397 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -65.14 -36.38 84.08 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.966 0.412 . . . . 10.0 110.512 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 63.2 m -60.02 -31.69 70.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.673 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -69.96 -31.25 68.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.901 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -67.76 -37.19 81.78 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.679 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -89.27 -14.32 36.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.352 -0.386 . . . . 10.0 111.269 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.94 36.14 29.16 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.896 -0.669 . . . . 10.0 112.392 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.1 m -123.71 159.78 54.21 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 110.561 -0.163 . . . . 10.0 110.561 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -68.27 167.22 22.73 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.221 1.947 . . . . 10.0 111.733 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.46 140.23 57.08 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.209 -179.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.8 t30 69.83 22.17 6.08 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.251 -0.886 . . . . 10.0 112.632 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.9 p -87.82 -23.17 24.11 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.44 0.638 . . . . 10.0 109.358 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 37.2 mt -117.69 134.98 54.33 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.372 -0.831 . . . . 10.0 109.786 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.426 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.2 ptt-85 -104.03 127.27 51.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.121 0.486 . . . . 10.0 110.393 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.449 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 87.4 m-85 -90.13 123.71 34.2 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.475 -0.784 . . . . 10.0 109.983 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.3 mt -110.51 118.35 36.01 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.106 0.479 . . . . 10.0 111.019 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -125.61 116.28 21.47 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.353 -0.84 . . . . 10.0 108.793 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 64.9 25.3 12.78 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.125 0.488 . . . . 10.0 110.737 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.19 -9.63 76.18 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.722 -0.672 . . . . 10.0 112.909 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -107.14 145.27 32.73 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 122.649 -0.324 . . . . 10.0 110.389 -179.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.449 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 14.2 ptm180 -82.5 137.03 34.74 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.234 0.54 . . . . 10.0 110.706 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.2 mm -71.64 119.92 18.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.848 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -74.32 164.22 26.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.427 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.583 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 0.1 OUTLIER -78.34 -1.8 35.04 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.985 0.421 . . . . 10.0 111.501 -179.016 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -121.87 16.1 10.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.254 0.55 . . . . 10.0 110.301 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -84.13 148.11 26.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.238 -179.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.537 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.3 OUTLIER -119.24 145.31 38.12 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.516 -0.765 . . . . 10.0 109.465 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -60.42 -16.07 39.58 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.415 2.076 . . . . 10.0 112.574 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -69.35 -42.86 74.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.741 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 76' ' ' THR . 8.8 pt-20 -84.25 177.26 8.26 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.434 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 11.0 mt 72.94 -54.62 0.69 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.1 0.56 . . . . 10.0 110.773 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 119.2 64.13 0.28 Allowed Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.976 -0.63 . . . . 10.0 112.652 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 47.9 mtt -97.79 135.04 40.13 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.828 0.347 . . . . 10.0 110.586 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.411 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 4.9 mm-40 -133.19 -176.29 4.08 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.2 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 38.8 tp10 -71.09 139.71 50.44 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.663 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 65.65 25.42 11.58 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.209 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -72.27 156.74 38.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.44 -0.345 . . . . 10.0 110.242 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.5 t -111.45 130.94 64.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.894 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.0 tt -137.15 142.31 37.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -102.35 150.69 23.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.89 0.376 . . . . 10.0 111.451 -178.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -131.61 124.61 54.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.877 -0.602 . . . . 10.0 109.533 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -127.36 158.16 38.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.425 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -87.63 130.92 34.61 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.865 0.364 . . . . 10.0 111.636 -178.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.426 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 6.4 mm-40 -71.9 143.5 49.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.879 -0.601 . . . . 10.0 109.97 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -68.32 -25.69 65.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.059 -0.519 . . . . 10.0 111.493 -179.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 32.5 p -71.88 -28.47 63.54 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.937 0.398 . . . . 10.0 110.967 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 80.61 10.4 85.27 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.937 -0.649 . . . . 10.0 111.98 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.949 0 CA-C-O 118.84 -0.978 . . . . 10.0 111.322 -179.862 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 55.7 t30 . . . . . 0 N--CA 1.483 1.186 0 CA-C-O 121.134 0.493 . . . . 10.0 110.26 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . 0.479 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 50.1 t30 -120.69 123.76 43.52 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.557 -0.905 . . . . 10.0 108.557 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -125.91 127.08 45.44 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . 0.436 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 20.6 t0 -122.71 128.7 25.3 Favored Pre-proline 0 C--N 1.318 -0.776 0 N-CA-C 107.394 -1.336 . . . . 10.0 107.394 176.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 57.9 Cg_endo -111.14 128.79 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.184 0 C-N-CA 121.728 1.619 . . . . 10.0 113.638 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.2 mt -119.67 136.93 55.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 113.702 -1.59 . . . . 10.0 109.732 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -113.07 135.77 51.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.394 0.616 . . . . 10.0 109.643 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 5.2 tp -113.16 144.16 21.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.272 -0.876 . . . . 10.0 111.765 -176.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . 0.541 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 0.2 OUTLIER -113.77 131.32 56.25 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.968 -1.015 . . . . 10.0 112.026 -175.455 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . 0.404 ' P ' ' HZ2' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo . . . . . 0 C--O 1.25 1.077 0 C-N-CA 123.211 2.607 . . . . 10.0 112.712 -179.53 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 110.126 -0.324 . . . . 10.0 110.126 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.6 mm -102.79 108.98 25.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.421 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -93.87 96.3 9.65 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.207 0.527 . . . . 10.0 110.61 -179.301 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 45.0 mt -82.23 149.83 27.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.614 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -105.82 107.89 19.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.24 -0.437 . . . . 10.0 110.201 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.454 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.8 t -89.3 121.83 39.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.371 -0.603 . . . . 10.0 109.371 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.0 mm -86.83 110.85 20.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.904 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.82 159.77 44.26 Favored Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 120.871 -0.68 . . . . 10.0 111.553 179.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -62.68 -32.23 73.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.737 0.269 . . . . 10.0 111.525 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -91.75 27.65 2.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.883 0.373 . . . . 10.0 111.342 -179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.9 m 62.56 37.95 12.76 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.777 -0.647 . . . . 10.0 111.179 179.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.85 143.53 26.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.855 -0.611 . . . . 10.0 109.916 179.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.447 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 20.9 mt-10 -109.14 97.43 7.04 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.114 0.483 . . . . 10.0 110.654 -179.492 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.454 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 3.0 mm -87.28 127.06 40.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.907 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -103.22 102.6 12.59 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.021 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.19 116.39 30.31 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.7 ttmt -87.44 95.13 9.9 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.76 -0.655 . . . . 10.0 109.611 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.1 m -101.06 163.95 2.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.461 . . . . 10.0 111.516 -178.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -113.83 142.4 46.14 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.869 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 54.3 tpp -80.42 76.8 7.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.999 0.428 . . . . 10.0 111.663 -179.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.3 t 173.68 -35.54 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.883 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.21 132.65 42.37 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.14 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.7 m80 -64.69 155.95 31.85 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.034 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 48.3 mt -74.51 -0.9 19.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.737 0.303 . . . . 10.0 110.687 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.529 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 12.2 tptp -59.62 -57.33 13.42 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.604 ' HZ3' ' P ' ' B' ' 365' ' ' SEP . 4.7 tppp? -59.15 -35.39 73.42 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.482 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.67 -48.16 75.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.044 -0.525 . . . . 10.0 111.679 -179.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -58.39 -48.46 80.58 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.951 0.352 . . . . 10.0 111.951 -179.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 4.6 pt-20 -70.58 -31.37 68.35 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.015 0.376 . . . . 10.0 112.015 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.0 m -71.95 -36.91 70.01 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.942 -0.303 . . . . 10.0 110.974 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -64.98 -39.34 93.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.852 0.358 . . . . 10.0 110.092 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.41 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 58.6 m -62.1 -36.08 80.64 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 178.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -66.85 -39.12 87.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.348 179.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -63.38 -41.23 98.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.616 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -78.2 -16.42 57.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.817 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.03 31.83 41.81 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.888 -0.672 . . . . 10.0 112.431 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.7 m -128.34 158.06 72.61 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 110.648 -0.13 . . . . 10.0 110.648 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -64.98 161.62 36.02 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.37 2.046 . . . . 10.0 111.311 178.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.41 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 21.6 ttt -72.22 152.25 42.34 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.038 -0.265 . . . . 10.0 111.124 -179.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 11.7 t30 79.13 -3.57 2.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.024 0.93 . . . . 10.0 111.924 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 81.1 p -78.28 -18.23 55.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.255 0.55 . . . . 10.0 109.795 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 56.9 mt -120.84 135.35 55.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.16 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.493 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 10.7 ptt180 -105.38 125.28 50.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.045 0.45 . . . . 10.0 110.323 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -88.28 117.59 27.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.885 179.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.3 mt -107.52 123.6 48.67 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.123 0.487 . . . . 10.0 110.346 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -127.27 98.61 5.34 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.582 -0.735 . . . . 10.0 109.839 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 62.29 49.13 4.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.279 -0.873 . . . . 10.0 111.351 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.02 -50.87 2.51 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.962 -0.637 . . . . 10.0 113.49 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -80.38 163.19 24.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.868 0.366 . . . . 10.0 111.34 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -101.91 152.4 20.96 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.375 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 46.2 mm -82.33 121.26 35.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.96 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -79.56 163.78 24.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.994 -0.548 . . . . 10.0 109.883 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.67 -21.0 61.14 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.837 0.351 . . . . 10.0 111.706 -179.204 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -100.83 5.37 43.43 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.697 -0.228 . . . . 10.0 111.235 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -74.65 149.03 40.15 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.599 -179.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 23.9 p -123.23 157.42 61.22 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.109 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -69.0 -8.06 22.55 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.514 2.143 . . . . 10.0 112.253 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -79.25 -35.97 40.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.773 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.479 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 7.8 pt-20 -92.21 173.03 8.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.037 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.479 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 52.2 mt 73.78 -42.39 0.51 Allowed 'General case' 0 N--CA 1.469 0.519 0 O-C-N 123.692 0.62 . . . . 10.0 110.947 -179.204 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.418 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 105.41 84.95 1.79 Allowed Glycine 0 N--CA 1.444 -0.824 0 C-N-CA 121.174 -0.536 . . . . 10.0 112.362 179.55 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 52.5 mtt -114.88 148.26 38.84 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.847 -0.427 . . . . 10.0 109.847 179.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.438 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.9 mm-40 -146.12 174.67 11.1 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.954 0.406 . . . . 10.0 110.971 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 20.7 tp10 -65.9 135.5 54.86 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.896 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 18.5 mm-40 69.26 25.65 5.58 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 123.574 0.546 . . . . 10.0 111.558 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.438 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.3 t0 -71.92 167.2 20.57 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.824 -0.351 . . . . 10.0 110.091 179.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.0 t -113.9 117.57 55.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 120.912 0.387 . . . . 10.0 111.836 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 16.9 tt -125.72 139.54 51.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.812 -0.631 . . . . 10.0 109.32 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -113.25 146.63 39.03 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.865 0.364 . . . . 10.0 111.1 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.2 p -133.92 130.76 55.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.145 -0.48 . . . . 10.0 109.811 179.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -134.49 166.6 22.5 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.34 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -76.29 141.47 41.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.685 0.278 . . . . 10.0 110.813 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.493 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 1.1 mm-40 -86.41 151.27 23.68 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.368 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -72.61 -22.08 61.01 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.231 0.539 . . . . 10.0 110.262 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -30.79 69.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.585 -0.734 . . . . 10.0 110.843 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 88.08 -9.99 72.58 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.892 -0.67 . . . . 10.0 113.051 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.837 0 CA-C-O 118.492 -1.171 . . . . 10.0 111.633 -179.807 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 121.075 0.464 . . . . 10.0 110.599 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -119.7 122.51 41.64 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.607 -0.437 . . . . 10.0 109.88 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . 0.447 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 14.7 ptt180 -124.94 128.59 48.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.247 0.546 . . . . 10.0 112.309 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . 0.427 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 32.4 t0 -123.41 128.57 25.19 Favored Pre-proline 0 C--N 1.32 -0.708 0 N-CA-C 107.601 -1.259 . . . . 10.0 107.601 177.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 67.3 Cg_endo -107.91 127.61 0.05 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 121.545 1.497 . . . . 10.0 112.868 -179.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . 0.431 HD11 HG22 ' B' ' 362' ' ' ILE . 3.0 mt -117.9 136.96 53.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 114.364 -1.289 . . . . 10.0 110.186 -178.204 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 40.7 t -112.54 135.57 51.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.477 0.656 . . . . 10.0 110.312 -178.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 7.9 tp -112.31 144.83 19.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 114.444 -1.253 . . . . 10.0 110.729 -177.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . 0.604 ' P ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -114.24 131.29 56.53 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.829 -1.078 . . . . 10.0 111.313 -176.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo . . . . . 0 C--O 1.251 1.149 0 C-N-CA 123.479 2.786 . . . . 10.0 113.145 -179.941 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.688 0.28 . . . . 10.0 110.357 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.1 mm -100.95 116.84 45.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.617 ' HE2' ' ND1' ' A' ' 35' ' ' HIS . 0.4 OUTLIER -100.43 105.56 17.05 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.119 0.485 . . . . 10.0 110.763 -179.481 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.8 mt -88.57 150.85 22.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.21 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 44.1 mtpt -110.19 119.59 39.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.0 0.429 . . . . 10.0 110.454 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.7 t -102.11 131.35 50.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.712 -0.677 . . . . 10.0 109.44 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.8 mm -101.33 118.31 47.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.899 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.4 155.81 25.36 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.981 -0.628 . . . . 10.0 112.153 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -65.79 -20.73 66.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.008 0.432 . . . . 10.0 111.053 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -89.84 12.59 16.81 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.777 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.9 m 71.22 39.58 0.94 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.533 -0.758 . . . . 10.0 111.578 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 20.7 p -102.84 140.52 37.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.243 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -107.91 99.46 8.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.121 0.486 . . . . 10.0 109.985 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.0 mm -89.04 134.22 29.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.151 -178.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.617 ' ND1' ' HE2' ' A' ' 23' ' ' LYS . 97.5 m-70 -111.44 105.97 14.74 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.603 -0.518 . . . . 10.0 109.603 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -104.02 117.62 34.73 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.875 0.369 . . . . 10.0 110.487 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.9 ttmt -89.58 100.5 13.29 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.119 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 m -103.2 170.18 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.515 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -121.2 142.73 49.62 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 110.079 -0.341 . . . . 10.0 110.079 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.448 ' O ' ' HB ' ' A' ' 41' ' ' THR . 48.7 tpp -74.96 71.39 2.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.442 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.448 ' HB ' ' O ' ' A' ' 40' ' ' MET . 10.1 t 171.86 -29.96 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.278 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.08 139.48 44.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.205 -179.464 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -68.02 137.57 55.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.231 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.418 HD11 ' HB3' ' A' ' 75' ' ' HIS . 63.9 mt -68.08 -9.23 44.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.347 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.0 tptt -58.53 -47.1 85.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.297 0.57 . . . . 10.0 109.471 178.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.486 ' HZ3' ' P ' ' B' ' 365' ' ' SEP . 5.3 tppp? -65.42 -34.46 78.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.236 -0.893 . . . . 10.0 110.539 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -68.66 -45.32 72.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.822 -0.626 . . . . 10.0 111.173 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -61.56 -45.67 93.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.812 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.434 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 11.1 pt-20 -70.08 -40.27 75.09 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.937 -0.305 . . . . 10.0 111.371 -179.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.3 m -61.91 -34.82 76.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.818 0.342 . . . . 10.0 110.772 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -65.79 -40.73 92.24 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.673 -0.492 . . . . 10.0 109.673 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 57.9 m -63.92 -39.78 94.95 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.255 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.434 ' HG3' ' O ' ' A' ' 49' ' ' GLU . 79.7 mt-30 -65.26 -41.62 94.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.411 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -64.77 -37.45 87.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.938 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -85.75 -3.32 58.87 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.03 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.3 39.65 98.08 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.234 -0.507 . . . . 10.0 112.516 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.3 m -124.14 156.2 66.69 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.46 ' HG2' ' HB3' ' A' ' 61' ' ' SER . 11.0 Cg_endo -58.36 165.41 7.48 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.697 2.264 . . . . 10.0 112.431 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 22.4 ttt -69.1 132.28 46.33 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.617 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.0 t30 66.29 25.5 10.49 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.271 -0.877 . . . . 10.0 111.996 179.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.46 ' HB3' ' HG2' ' A' ' 58' ' ' PRO . 12.6 p -77.32 -22.32 52.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.564 0.697 . . . . 10.0 109.816 178.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.9 mt -117.92 141.59 48.27 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.082 -0.963 . . . . 10.0 110.372 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.439 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 20.5 ptt-85 -104.87 128.7 53.17 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.751 178.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -94.5 123.97 38.24 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.163 -0.472 . . . . 10.0 110.014 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.7 mt -112.26 121.6 45.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.894 -179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -124.15 113.56 18.5 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.365 -0.834 . . . . 10.0 108.866 178.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 63.12 28.75 16.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.253 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 88.0 -4.89 85.47 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 121.088 -0.577 . . . . 10.0 113.126 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -109.33 145.96 35.15 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.948 -0.39 . . . . 10.0 109.948 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -85.86 139.54 31.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.194 0.521 . . . . 10.0 110.795 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.5 mm -74.91 121.5 26.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.881 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -75.29 164.39 26.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.014 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.87 -27.09 60.11 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.698 0.285 . . . . 10.0 111.089 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 -99.99 22.88 10.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.962 0.411 . . . . 10.0 110.562 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.418 ' HB3' HD11 ' A' ' 44' ' ' LEU . 1.5 m170 -85.03 157.05 20.85 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.109 0.481 . . . . 10.0 111.309 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.531 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.2 OUTLIER -134.56 152.3 77.55 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.742 179.108 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -63.11 -13.15 33.67 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.583 2.189 . . . . 10.0 113.013 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.0 tppt? -69.63 -40.98 76.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.441 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 76' ' ' THR . 7.6 pt-20 -85.36 169.01 14.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.095 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 22.8 mt 73.78 -60.06 0.54 Allowed 'General case' 0 N--CA 1.468 0.427 0 O-C-N 123.828 0.705 . . . . 10.0 110.599 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 119.79 76.76 0.49 Allowed Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.936 -0.65 . . . . 10.0 112.177 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 65.1 mtt -104.08 118.04 35.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.726 0.298 . . . . 10.0 110.489 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 17.4 mm-40 -112.51 -177.67 3.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.663 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.477 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 38.6 tp10 -73.85 140.62 45.86 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.224 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 20.3 mm-40 70.49 20.79 5.8 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.638 0.586 . . . . 10.0 111.009 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.446 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.6 OUTLIER -71.98 150.24 44.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.077 179.568 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 40.2 t -109.4 122.28 63.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.079 0.466 . . . . 10.0 111.572 -178.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.8 tt -121.65 142.15 39.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -102.58 145.8 29.09 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.711 0.291 . . . . 10.0 111.353 -178.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.4 p -130.46 125.55 59.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.188 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -133.66 156.57 47.67 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.223 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.67 142.24 38.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.79 0.329 . . . . 10.0 111.219 -179.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.439 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.9 mm-40 -81.18 149.62 29.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.411 179.508 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -66.43 -37.15 84.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.106 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 6.4 p -76.38 -12.27 60.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.498 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 84.94 -10.22 63.54 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.835 -0.698 . . . . 10.0 112.092 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.939 0 N-CA-C 110.922 -0.871 . . . . 10.0 110.922 -179.834 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 . . . . . 0 N--CA 1.479 1.023 0 CA-C-O 121.359 0.599 . . . . 10.0 110.35 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -118.5 126.69 52.55 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 108.179 -1.045 . . . . 10.0 108.179 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -124.86 128.07 48.11 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 113.162 0.801 . . . . 10.0 113.162 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -124.0 127.43 25.39 Favored Pre-proline 0 C--N 1.314 -0.943 0 N-CA-C 107.429 -1.323 . . . . 10.0 107.429 175.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -109.81 127.85 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.22 0 C-N-CA 121.779 1.652 . . . . 10.0 113.021 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.5 mt -118.64 136.01 57.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 114.182 -1.372 . . . . 10.0 110.056 -179.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 13.6 t -113.02 137.2 46.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 108.972 -0.751 . . . . 10.0 108.972 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 6.4 tp -110.82 147.46 14.89 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 114.867 -1.061 . . . . 10.0 111.696 -176.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . 0.486 ' P ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -111.74 128.05 55.97 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.871 -1.058 . . . . 10.0 110.649 -176.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 C--O 1.246 0.92 0 C-N-CA 123.017 2.478 . . . . 10.0 112.179 179.61 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.3 mm -105.48 114.01 43.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.379 -0.6 . . . . 10.0 109.379 179.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.424 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.7 ttpm? -99.62 103.05 14.73 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.029 0.442 . . . . 10.0 110.506 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 21.8 mt -88.2 153.13 21.48 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.716 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.9 mtpt -107.41 111.15 23.33 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.297 -0.41 . . . . 10.0 109.982 179.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.6 t -95.41 125.82 48.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.874 -0.603 . . . . 10.0 109.62 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.1 mm -95.83 118.87 43.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 120.966 0.413 . . . . 10.0 110.63 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.76 164.75 36.03 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.815 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -62.27 -27.96 69.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.651 0.263 . . . . 10.0 111.378 -179.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -91.56 24.4 3.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.451 -0.34 . . . . 10.0 110.808 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.1 m 61.83 38.37 14.77 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.873 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -93.33 145.02 24.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.969 -0.56 . . . . 10.0 109.831 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.509 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 4.3 mt-10 -113.48 98.42 7.07 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.228 0.537 . . . . 10.0 110.337 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.471 HG21 HD13 ' A' ' 34' ' ' ILE . 3.8 mm -87.13 128.13 40.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.723 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.9 m170 -99.13 94.58 6.58 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.633 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.75 113.31 25.35 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.833 0.349 . . . . 10.0 110.21 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -92.68 103.93 16.26 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.418 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 m -104.38 170.15 2.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.871 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -119.0 139.99 50.77 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.435 ' C ' ' HG1' ' A' ' 41' ' ' THR . 56.8 tpp -76.81 62.7 2.08 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.167 0.508 . . . . 10.0 110.379 179.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.435 ' HG1' ' C ' ' A' ' 40' ' ' MET . 14.5 m -163.15 -38.19 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.219 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.442 ' OG1' ' HB2' ' B' ' 366' ' ' ASP . 0.2 OUTLIER -80.85 152.24 28.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.721 -0.672 . . . . 10.0 112.172 -178.954 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -80.67 152.69 28.32 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.551 -0.749 . . . . 10.0 109.536 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.9 mt -69.66 -6.7 33.24 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.813 0.301 . . . . 10.0 111.813 -179.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.415 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 50.0 tptt -60.15 -51.31 70.14 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.827 -0.434 . . . . 10.0 109.827 178.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.8 tppp? -62.63 -33.51 75.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.539 -0.755 . . . . 10.0 110.651 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.51 -47.13 67.78 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.07 -0.514 . . . . 10.0 111.57 -179.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -61.82 -45.19 94.92 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.07 0.396 . . . . 10.0 112.07 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 9.8 pt-20 -68.78 -35.14 76.68 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.75 0.278 . . . . 10.0 111.75 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 64.6 m -68.68 -33.02 73.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.755 0.312 . . . . 10.0 110.712 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.433 ' CG ' ' HZ ' ' A' ' 64' ' ' PHE . 30.5 t80 -68.54 -42.25 78.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.937 0.398 . . . . 10.0 110.185 179.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 56.0 m -60.91 -41.82 96.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.954 -0.567 . . . . 10.0 110.216 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -67.08 -30.76 70.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.79 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -69.47 -39.71 77.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.651 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -82.26 -15.75 51.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.216 -179.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.07 39.15 10.32 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.653 -0.784 . . . . 10.0 112.387 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.2 m -135.85 153.49 77.19 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 110.08 -0.341 . . . . 10.0 110.08 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -66.29 159.1 51.64 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.232 1.954 . . . . 10.0 111.103 178.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 17.2 ttt -68.03 159.53 30.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.714 0.292 . . . . 10.0 111.252 -179.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.0 t30 79.7 -16.9 0.62 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.163 0.985 . . . . 10.0 111.743 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 81.0 p -68.49 -37.73 80.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.122 0.487 . . . . 10.0 110.026 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 94.1 mt -102.6 125.33 49.29 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.577 -0.738 . . . . 10.0 110.308 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.487 ' HD3' ' OE2' ' A' ' 93' ' ' GLU . 18.2 ptt180 -106.18 124.78 50.12 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.145 0.498 . . . . 10.0 110.417 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.433 ' HZ ' ' CG ' ' A' ' 51' ' ' TYR . 50.7 m-85 -86.51 126.61 34.56 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.483 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 82.5 mt -113.43 127.7 56.2 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.174 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -135.38 115.72 13.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.464 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 62.3 29.36 17.32 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.529 0.518 . . . . 10.0 110.925 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.32 -37.23 3.48 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.967 -0.635 . . . . 10.0 112.885 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -81.02 158.72 25.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.7 0.286 . . . . 10.0 110.621 -179.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.0 ptm180 -96.54 140.66 30.84 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.979 0.419 . . . . 10.0 110.174 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.0 mm -74.15 123.95 30.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.414 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.58 166.9 17.82 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.51 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -81.08 -3.25 51.29 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.933 -178.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.7 p-10 -115.88 4.79 13.93 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.841 0.353 . . . . 10.0 110.624 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 21.5 m170 -78.45 152.57 32.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.398 -179.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.479 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 11.2 p -123.41 153.98 65.75 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.172 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -66.6 -14.28 43.35 Favored 'Trans proline' 0 N--CA 1.472 0.236 0 C-N-CA 122.484 2.123 . . . . 10.0 112.639 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -73.93 -30.65 62.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.538 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 76' ' ' THR . 13.9 pt-20 -98.6 173.49 6.9 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.738 -0.467 . . . . 10.0 109.738 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.404 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 58.4 mt 73.01 -46.96 0.66 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 123.634 0.584 . . . . 10.0 111.235 -179.583 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 112.4 77.03 0.81 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 121.092 -0.575 . . . . 10.0 112.732 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 56.5 mtt -111.67 115.72 29.59 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.748 0.308 . . . . 10.0 110.35 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 25.1 mm-40 -114.35 177.62 4.58 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.069 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 29.1 tp10 -69.7 139.11 53.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.076 179.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.435 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 13.1 mm-40 70.57 11.85 7.32 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 123.483 0.49 . . . . 10.0 111.927 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.444 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.3 OUTLIER -68.8 147.61 51.51 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.97 -0.292 . . . . 10.0 110.309 179.705 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 92.6 t -98.1 126.39 51.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 121.241 0.543 . . . . 10.0 111.59 -178.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.5 tt -126.39 142.9 41.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.53 -0.759 . . . . 10.0 109.136 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -108.18 157.21 18.51 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.101 0.477 . . . . 10.0 111.841 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.4 p -146.85 125.39 4.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.436 178.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -133.98 169.38 17.2 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.387 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -81.58 134.65 35.52 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.848 0.356 . . . . 10.0 110.965 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.487 ' OE2' ' HD3' ' A' ' 63' ' ' ARG . 2.6 mm-40 -69.42 173.91 5.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.565 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -78.44 -31.35 48.01 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.921 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 16.6 p -72.46 -33.32 66.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.568 -0.742 . . . . 10.0 111.321 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.78 6.32 80.03 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 110.96 -0.856 . . . . 10.0 110.96 -178.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.978 0 N-CA-C 110.716 -0.953 . . . . 10.0 110.716 -179.788 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 66.3 t30 . . . . . 0 N--CA 1.483 1.177 0 CA-C-O 121.283 0.563 . . . . 10.0 110.988 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . 0.509 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 5.9 t-20 -120.34 121.09 37.83 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 108.468 -0.938 . . . . 10.0 108.468 178.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . 0.429 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 16.8 ptt180 -128.66 129.57 46.02 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 113.327 0.862 . . . . 10.0 113.327 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -122.54 130.44 24.66 Favored Pre-proline 0 C--N 1.317 -0.823 0 N-CA-C 107.872 -1.159 . . . . 10.0 107.872 176.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -108.36 127.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 121.246 1.297 . . . . 10.0 113.719 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.2 mt -119.26 135.08 60.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 114.407 -1.27 . . . . 10.0 109.93 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 21.0 t -114.49 135.24 54.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 N-CA-C 109.014 -0.735 . . . . 10.0 109.014 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 6.5 tp -113.78 144.43 21.4 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 CA-C-N 115.082 -0.963 . . . . 10.0 111.502 -176.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . 0.442 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 4.7 t70 -112.09 130.15 55.98 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.123 -0.944 . . . . 10.0 111.836 -175.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . 0.412 ' HA ' ' HD3' ' B' ' 368' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' B' ' 367' ' ' SEP . 16.2 Cg_exo . . . . . 0 C--O 1.248 0.994 0 C-N-CA 122.591 2.194 . . . . 10.0 110.96 178.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 110.382 -0.229 . . . . 10.0 110.382 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.5 mm -110.95 118.87 58.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -100.4 108.71 20.78 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.119 0.485 . . . . 10.0 111.624 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.8 mt -91.46 147.66 22.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.546 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt -105.25 104.58 14.33 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.077 0.465 . . . . 10.0 110.363 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.436 ' O ' HG12 ' A' ' 34' ' ' ILE . 3.6 t -87.77 125.97 41.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.685 -0.689 . . . . 10.0 109.369 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.6 mm -99.44 116.05 41.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 120.888 0.375 . . . . 10.0 110.575 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.84 169.66 42.81 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.719 -0.753 . . . . 10.0 111.93 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -60.02 -33.17 71.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.357 . . . . 10.0 111.486 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.424 ' CG ' ' HG ' ' A' ' 32' ' ' SER . 9.3 p-10 -86.69 23.25 1.72 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.572 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 72.2 m 61.37 32.21 19.13 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.259 0.552 . . . . 10.0 111.066 179.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.424 ' HG ' ' CG ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -85.03 140.1 31.28 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.73 -0.668 . . . . 10.0 109.714 179.303 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.483 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 12.8 mt-10 -107.62 96.47 6.42 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.106 0.479 . . . . 10.0 110.251 -179.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.436 HG12 ' O ' ' A' ' 26' ' ' VAL . 1.2 mm -82.66 127.44 39.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.657 -179.169 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -96.17 87.68 4.6 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.36 106.26 17.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.336 -179.251 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -92.2 104.69 17.03 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.946 0.403 . . . . 10.0 110.701 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 5.1 m -103.45 167.16 2.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.202 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 64.8 tttt -117.31 137.8 52.19 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 110.164 -0.31 . . . . 10.0 110.164 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.416 ' O ' ' HB ' ' A' ' 41' ' ' THR . 57.6 tpp -75.11 76.13 2.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.014 0.435 . . . . 10.0 110.711 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.416 ' HB ' ' O ' ' A' ' 40' ' ' MET . 8.7 t 173.13 -30.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.127 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.67 145.86 28.56 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.406 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -76.43 147.32 38.03 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.189 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.2 mt -69.02 -7.33 34.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.951 0.405 . . . . 10.0 110.657 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 28.2 tptt -56.15 -52.58 63.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.24 178.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -69.9 -32.83 71.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.685 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -63.87 -39.47 94.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.273 -0.421 . . . . 10.0 111.045 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -61.69 -44.27 97.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.67 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -76.03 -28.67 57.81 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 121.017 -0.273 . . . . 10.0 111.368 -179.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.401 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 66.4 m -63.24 -38.7 92.18 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.952 0.406 . . . . 10.0 111.008 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -67.07 -35.33 79.59 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.898 -0.408 . . . . 10.0 109.898 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.465 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.9 m -62.19 -40.57 96.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.736 -0.666 . . . . 10.0 109.895 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.401 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.3 mt-30 -64.21 -41.08 97.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.527 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -66.95 -32.41 73.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.176 -0.466 . . . . 10.0 110.678 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -84.84 -11.85 54.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.129 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.93 32.31 63.69 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.994 -0.622 . . . . 10.0 112.266 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.9 m -131.37 154.59 81.96 Favored Pre-proline 0 C--N 1.324 -0.543 0 N-CA-C 110.54 -0.171 . . . . 10.0 110.54 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -64.27 164.29 23.37 Favored 'Trans proline' 0 CA--C 1.53 0.277 0 C-N-CA 122.449 2.099 . . . . 10.0 111.577 178.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.465 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 11.6 ttt -72.61 157.83 36.82 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 121.236 -0.186 . . . . 10.0 110.934 -179.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.3 t30 75.12 5.35 4.25 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.525 0.73 . . . . 10.0 111.947 178.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 55.6 p -86.69 -26.36 24.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.371 0.605 . . . . 10.0 109.926 179.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 48.7 mt -117.35 143.23 46.18 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.406 -0.815 . . . . 10.0 110.678 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.513 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 14.2 ptt-85 -115.42 127.7 55.54 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.284 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.445 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 25.3 m-85 -90.37 121.72 32.61 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.061 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 55.4 mt -107.94 111.44 23.54 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.128 0.489 . . . . 10.0 110.709 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -121.7 121.84 38.23 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.409 -0.814 . . . . 10.0 109.022 179.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 63.2 19.34 11.61 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.434 0.459 . . . . 10.0 110.962 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.62 -21.86 43.88 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.925 -0.655 . . . . 10.0 112.585 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -98.14 161.23 13.82 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.572 0.225 . . . . 10.0 110.636 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.445 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 13.3 ptm180 -95.46 143.45 26.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.017 0.437 . . . . 10.0 110.698 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.3 mm -77.95 127.36 38.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.646 -0.706 . . . . 10.0 111.803 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.94 166.44 13.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.33 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -73.35 -13.64 61.14 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.659 0.266 . . . . 10.0 111.521 -179.284 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -105.64 10.7 32.84 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.791 0.329 . . . . 10.0 111.229 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.6 m170 -83.65 149.03 26.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.102 0.477 . . . . 10.0 111.124 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.41 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -129.42 148.09 67.82 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.692 178.888 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -64.32 -6.69 12.21 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.718 2.279 . . . . 10.0 112.798 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.9 tppt? -75.15 -27.27 59.65 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.902 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 76' ' ' THR . 3.2 pt-20 -108.69 -174.99 2.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.556 -179.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 41.0 mt 72.17 -58.49 0.59 Allowed 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.894 0.746 . . . . 10.0 110.922 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 129.36 61.16 0.1 Allowed Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 111.693 -0.563 . . . . 10.0 111.693 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 39.8 mtt -98.16 126.22 43.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.935 0.398 . . . . 10.0 110.644 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.487 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -129.84 173.27 10.83 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.364 179.893 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -66.17 138.33 57.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.235 -0.439 . . . . 10.0 109.834 179.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 69.63 25.89 5.13 Favored 'General case' 0 C--O 1.233 0.198 0 O-C-N 123.65 0.594 . . . . 10.0 111.546 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.487 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.6 OUTLIER -74.5 146.33 42.81 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 179.19 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 41.6 t -99.48 126.07 52.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.03 0.443 . . . . 10.0 111.186 -179.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.7 tt -135.36 143.01 38.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.971 -0.559 . . . . 10.0 109.683 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -110.47 153.62 24.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.018 0.437 . . . . 10.0 110.848 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.9 p -132.42 129.61 59.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.624 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -125.32 165.21 18.77 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.474 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -91.03 132.92 35.71 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.293 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.513 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.9 mm-40 -77.17 152.82 34.66 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.85 0.357 . . . . 10.0 110.807 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -77.64 -14.43 59.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.301 0.572 . . . . 10.0 110.024 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.6 p -71.36 -43.73 66.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.53 -0.759 . . . . 10.0 110.706 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 102.9 -16.21 54.62 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.989 -0.625 . . . . 10.0 112.324 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.933 0 CA-C-O 118.897 -0.946 . . . . 10.0 111.337 -179.617 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 . . . . . 0 N--CA 1.484 1.225 0 CA-C-O 121.044 0.45 . . . . 10.0 110.837 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -120.29 123.13 42.4 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.509 -0.923 . . . . 10.0 108.509 178.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . 0.483 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 27.4 ptt180 -126.25 127.86 46.28 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 119.904 -0.718 . . . . 10.0 111.922 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 34.5 t70 -120.87 130.59 24.78 Favored Pre-proline 0 C--N 1.317 -0.819 0 N-CA-C 106.276 -1.749 . . . . 10.0 106.276 177.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 61.2 Cg_endo -108.05 129.22 0.05 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.281 0 C-N-CA 121.589 1.526 . . . . 10.0 114.005 -177.671 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 23.6 mt -119.08 132.09 69.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 CA-C-N 114.32 -1.309 . . . . 10.0 109.971 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 10.5 t -117.28 135.97 55.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 109.495 -0.557 . . . . 10.0 109.495 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 5.4 tp -112.71 146.65 17.16 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 CA-C-N 114.93 -1.032 . . . . 10.0 110.945 -177.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -110.44 130.23 55.6 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.281 -0.872 . . . . 10.0 111.636 -174.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo . . . . . 0 C--O 1.252 1.182 0 C-N-CA 122.509 2.139 . . . . 10.0 111.477 178.798 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 . . . . . 0 N--CA 1.482 1.167 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.4 mm -107.6 110.12 30.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.89 0.376 . . . . 10.0 110.089 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.428 ' NZ ' ' HB3' ' A' ' 23' ' ' LYS . 1.7 ttpm? -100.05 100.45 11.33 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.159 0.504 . . . . 10.0 110.513 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 33.3 mt -83.27 152.22 25.25 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.101 -179.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 40.4 mtpt -110.11 108.85 19.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.06 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.1 t -90.39 131.07 38.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.274 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.4 mm -89.98 110.83 22.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.464 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -76.14 152.9 42.57 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.846 -0.615 . . . . 10.0 112.172 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -61.88 -22.51 65.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.834 0.349 . . . . 10.0 111.553 -179.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -97.29 20.82 10.88 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.841 0.353 . . . . 10.0 110.569 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.2 m 67.42 44.94 1.67 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.605 -0.725 . . . . 10.0 111.128 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.8 p -107.3 149.74 27.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.634 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.44 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 10.0 mt-10 -107.5 101.95 11.26 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.6 mm -92.21 125.94 44.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.269 -179.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 23.5 m-70 -102.01 101.96 12.41 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.747 -0.464 . . . . 10.0 109.747 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.73 113.98 26.3 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.458 -179.38 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -85.7 99.51 11.36 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.867 -0.42 . . . . 10.0 109.867 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 m -106.13 168.88 2.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.996 -179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.462 ' HE2' ' OG1' ' A' ' 41' ' ' THR . 79.1 tttt -120.0 143.2 48.18 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.855 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 58.9 tpp -76.74 58.56 1.44 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.347 0.594 . . . . 10.0 110.507 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.462 ' OG1' ' HE2' ' A' ' 39' ' ' LYS . 5.7 m -158.07 -42.11 0.06 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.513 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.3 147.94 37.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.837 -0.619 . . . . 10.0 111.251 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.3 m80 -75.92 151.98 37.2 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 47' ' ' LEU . 12.6 mt -66.33 -12.45 56.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.753 0.311 . . . . 10.0 111.36 -179.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 43.4 tptt -59.12 -44.4 92.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.156 0.503 . . . . 10.0 109.67 178.129 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -64.69 -32.72 74.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.204 -0.907 . . . . 10.0 110.655 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 44' ' ' LEU . 2.5 mm? -74.96 -41.78 58.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.965 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -60.64 -47.71 85.04 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.898 -179.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -67.31 -46.73 72.65 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.946 0.35 . . . . 10.0 111.946 -178.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.7 m -61.09 -36.38 79.51 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.724 0.268 . . . . 10.0 111.724 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -64.65 -45.84 85.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.774 0.321 . . . . 10.0 110.465 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 60.3 m -59.93 -49.23 78.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.659 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -58.37 -39.88 80.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.128 0.489 . . . . 10.0 110.789 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -64.53 -39.58 94.03 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.154 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -80.3 -6.07 57.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.284 -0.416 . . . . 10.0 111.809 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.91 37.95 17.48 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.654 -0.784 . . . . 10.0 112.694 179.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -139.65 150.72 64.22 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 110.028 -0.36 . . . . 10.0 110.028 179.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.06 162.15 34.76 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.163 1.909 . . . . 10.0 111.424 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.486 ' HG3' ' N ' ' A' ' 60' ' ' ASN . 0.9 OUTLIER -62.84 147.83 48.91 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.893 -0.14 . . . . 10.0 110.637 179.431 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.486 ' N ' ' HG3' ' A' ' 59' ' ' MET . 35.7 t30 83.62 6.11 0.73 Allowed 'General case' 0 N--CA 1.475 0.823 0 O-C-N 124.069 0.856 . . . . 10.0 112.012 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 57.6 p -90.1 -33.88 16.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.041 0.448 . . . . 10.0 110.294 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 33.6 mt -115.2 146.46 41.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.675 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.517 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 15.0 ptt-85 -117.02 135.64 53.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.217 179.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -93.98 127.23 39.64 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.169 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.0 mt -109.86 124.15 50.83 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.552 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -138.04 121.69 17.43 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.385 -0.825 . . . . 10.0 109.208 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 61.91 24.97 14.95 Favored 'General case' 0 C--N 1.331 -0.221 0 O-C-N 123.483 0.49 . . . . 10.0 110.989 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.63 2.0 87.2 Favored Glycine 0 CA--C 1.522 0.474 0 C-N-CA 121.115 -0.564 . . . . 10.0 113.07 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -114.19 164.93 13.21 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.945 0.372 . . . . 10.0 110.572 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -100.3 130.26 46.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.015 0.435 . . . . 10.0 110.217 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.9 mm -67.57 124.44 22.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.383 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -85.08 172.76 11.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.304 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 2.6 m-20 -80.88 -15.45 56.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.883 0.373 . . . . 10.0 111.205 -179.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -107.49 30.18 6.5 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.219 0.533 . . . . 10.0 110.577 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 2.6 m170 -104.47 152.62 22.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.972 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.439 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 6.1 p -130.1 153.81 81.17 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.966 178.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -62.88 -13.78 36.85 Favored 'Trans proline' 0 N--CA 1.475 0.414 0 C-N-CA 122.701 2.267 . . . . 10.0 112.865 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -72.35 -34.36 67.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.839 -179.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 76' ' ' THR . 6.0 pt-20 -94.72 174.34 7.16 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.935 -0.395 . . . . 10.0 109.935 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 15.9 mt 73.84 -41.38 0.48 Allowed 'General case' 0 N--CA 1.468 0.431 0 O-C-N 123.684 0.615 . . . . 10.0 111.249 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 107.79 56.32 0.6 Allowed Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.883 -0.675 . . . . 10.0 112.341 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 47.5 mtt -90.5 128.91 36.68 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.5 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.3 mm-40 -126.56 -179.91 5.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.089 0.471 . . . . 10.0 111.635 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -68.07 140.02 56.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.645 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 62.01 23.61 13.94 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.024 -0.535 . . . . 10.0 111.709 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.5 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.7 t0 -70.75 148.88 47.48 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.204 -0.198 . . . . 10.0 110.548 179.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 89.7 t -97.61 114.02 33.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.036 0.446 . . . . 10.0 111.59 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.414 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 18.8 tt -119.61 142.48 34.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -110.83 151.94 27.24 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.029 0.443 . . . . 10.0 111.636 -178.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.2 p -136.25 125.54 38.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.64 179.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -131.8 157.24 44.39 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.409 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -75.97 138.89 41.24 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.904 0.383 . . . . 10.0 110.845 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.517 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.2 mm-40 -81.05 147.84 29.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.714 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -70.72 -15.4 62.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.08 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.31 -16.72 58.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.962 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.12 -47.3 3.55 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.963 -0.637 . . . . 10.0 112.352 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.821 0 N-CA-C 110.612 -0.995 . . . . 10.0 110.612 179.993 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 . . . . . 0 N--CA 1.477 0.9 0 CA-C-O 121.244 0.545 . . . . 10.0 109.912 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . 0.44 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 53.4 t-20 -121.7 123.86 42.87 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.192 -1.04 . . . . 10.0 108.192 179.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -123.12 122.72 39.15 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.414 -0.914 . . . . 10.0 112.811 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . 0.425 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 18.5 t70 -128.82 128.39 23.46 Favored Pre-proline 0 C--N 1.319 -0.755 0 N-CA-C 107.398 -1.334 . . . . 10.0 107.398 174.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 54.0 Cg_endo -111.72 128.44 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.141 0 C-N-CA 121.551 1.501 . . . . 10.0 113.789 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.1 mt -117.48 135.61 57.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.06 -0.973 . . . . 10.0 109.311 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 19.6 t -113.99 133.51 59.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.569 0.699 . . . . 10.0 110.626 -178.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 4.7 tp -116.27 143.05 27.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 114.985 -1.007 . . . . 10.0 111.014 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -110.09 128.6 55.53 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.506 0.669 . . . . 10.0 111.381 -175.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo . . . . . 0 C--O 1.248 1.012 0 C-N-CA 123.424 2.75 . . . . 10.0 112.749 179.719 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 . . . . . 0 N--CA 1.479 1.019 0 N-CA-C 110.246 -0.279 . . . . 10.0 110.246 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.1 mm -118.52 117.41 54.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.552 ' HZ3' ' CD ' ' A' ' 84' ' ' GLU . 0.0 OUTLIER -97.93 108.75 21.52 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.92 0.391 . . . . 10.0 110.855 -179.816 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 66.7 mt -94.26 126.85 39.76 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.966 -0.561 . . . . 10.0 109.909 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 34' ' ' ILE . 33.4 mtpt -96.84 109.7 22.34 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.01 0.433 . . . . 10.0 110.721 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.4 t -91.98 123.71 44.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.63 -0.713 . . . . 10.0 109.665 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.6 mm -94.06 113.22 28.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 120.984 0.421 . . . . 10.0 110.852 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.6 156.3 33.14 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.81 -0.632 . . . . 10.0 112.087 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -70.15 -12.4 61.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.875 0.369 . . . . 10.0 111.362 -179.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -100.69 22.43 11.94 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.35 0.595 . . . . 10.0 110.052 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.2 m 63.71 45.33 4.58 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 114.814 -1.085 . . . . 10.0 111.822 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.2 p -111.58 138.34 48.24 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.206 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.502 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 16.6 mt-10 -108.81 103.94 13.11 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.152 0.501 . . . . 10.0 109.942 179.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.469 ' O ' ' HA ' ' A' ' 25' ' ' LYS . 3.9 mm -91.18 129.91 41.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.443 -179.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.448 ' CD2' ' HB3' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -109.36 101.28 10.28 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.437 -0.347 . . . . 10.0 110.067 -179.696 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.23 115.35 27.3 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.2 -0.296 . . . . 10.0 110.2 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -88.06 100.13 12.7 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.0 m -107.45 174.04 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.996 0.427 . . . . 10.0 111.544 -178.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.3 tttt -123.23 146.7 47.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.817 -0.629 . . . . 10.0 109.493 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.478 ' O ' ' HB ' ' A' ' 41' ' ' THR . 49.0 tpp -77.64 76.02 4.18 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.089 0.471 . . . . 10.0 111.569 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.478 ' HB ' ' O ' ' A' ' 40' ' ' MET . 15.3 t 170.12 -25.83 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.466 -0.788 . . . . 10.0 110.0 178.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.426 ' OG1' ' HB2' ' B' ' 366' ' ' ASP . 0.9 OUTLIER -74.49 134.01 42.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.239 179.336 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 31.5 m170 -70.11 143.78 52.27 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.575 -179.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 75.2 mt -69.38 -8.59 47.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 10.0 111.042 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.502 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 37.4 tptt -58.18 -53.99 52.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.527 178.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -61.16 -41.74 97.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.525 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -57.97 -41.79 83.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.609 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -68.67 -31.98 71.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.403 -0.362 . . . . 10.0 111.315 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 39.7 mt-10 -75.32 -51.78 12.39 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.751 0.31 . . . . 10.0 111.306 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.0 m -61.33 -33.77 74.16 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.278 0.473 . . . . 10.0 112.278 -179.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -63.14 -46.06 89.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.706 0.288 . . . . 10.0 110.778 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.494 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 58.8 m -61.95 -37.23 83.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.093 0.473 . . . . 10.0 110.245 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -61.71 -42.84 99.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.764 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 52.9 ttt85 -69.22 -33.41 73.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.375 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -74.78 -16.42 60.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.708 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.88 30.92 45.66 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.911 -0.661 . . . . 10.0 112.84 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.8 m -137.49 154.53 75.27 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 110.205 -0.295 . . . . 10.0 110.205 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.51 154.64 58.02 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.443 2.095 . . . . 10.0 111.829 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.494 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 3.9 ttt -66.54 157.22 32.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.725 -0.216 . . . . 10.0 110.98 -179.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.449 ' N ' ' HG2' ' A' ' 59' ' ' MET . 4.3 t30 78.02 4.17 2.84 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.633 0.773 . . . . 10.0 111.571 179.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.4 p -87.88 -19.98 26.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.076 0.465 . . . . 10.0 109.958 179.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.0 mt -125.77 135.22 51.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.665 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.513 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 29.1 ptt-85 -112.09 138.96 48.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.241 -0.436 . . . . 10.0 109.88 179.202 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -96.19 132.03 42.04 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.9 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.0 mt -115.78 115.69 26.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.005 0.431 . . . . 10.0 111.132 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -128.07 118.57 23.71 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.563 -0.744 . . . . 10.0 109.357 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 61.66 29.97 18.35 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.079 0.466 . . . . 10.0 110.752 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.89 -4.28 75.84 Favored Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.862 -0.608 . . . . 10.0 112.604 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 44.8 mm-40 -102.34 136.79 41.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.576 0.226 . . . . 10.0 110.717 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -82.3 128.71 34.47 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.621 -0.511 . . . . 10.0 109.621 178.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 46.6 mm -70.03 118.84 15.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.229 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -90.11 168.78 11.7 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.295 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.91 -24.83 62.54 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.202 0.525 . . . . 10.0 110.579 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -95.77 24.97 4.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.423 -0.808 . . . . 10.0 111.58 -179.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 50.1 m170 -109.32 157.47 18.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.79 0.328 . . . . 10.0 110.837 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.567 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 27.9 p -134.26 160.31 68.97 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.067 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -68.73 -14.22 38.7 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.364 2.042 . . . . 10.0 112.012 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -69.65 -34.11 73.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.882 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.567 ' HG2' ' O ' ' A' ' 76' ' ' THR . 6.3 pt-20 -91.22 168.8 11.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.063 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 17.8 mt 73.01 -48.81 0.69 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.405 0.682 . . . . 10.0 111.432 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.14 58.89 0.33 Allowed Glycine 0 N--CA 1.444 -0.77 0 C-N-CA 120.652 -0.785 . . . . 10.0 112.558 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 43.6 mtt -86.34 120.21 27.44 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 179.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -113.17 178.14 4.38 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.204 0.525 . . . . 10.0 111.534 -178.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.552 ' CD ' ' HZ3' ' A' ' 23' ' ' LYS . 3.6 tp10 -69.01 140.52 54.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.413 -0.812 . . . . 10.0 110.762 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 63.6 mm-40 60.59 32.84 20.46 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.792 -0.64 . . . . 10.0 111.582 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -80.61 146.44 31.2 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.663 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 20.2 t -98.11 132.1 43.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.763 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 20.3 tt -135.42 149.34 28.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.018 179.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -108.95 152.49 24.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.982 0.42 . . . . 10.0 111.382 -179.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.8 p -135.22 135.86 51.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.469 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -137.37 157.22 47.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.716 -0.22 . . . . 10.0 110.791 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -80.61 131.36 35.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.581 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.513 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.6 mm-40 -69.47 145.28 52.86 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.879 -179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -63.21 -23.13 67.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.07 -0.514 . . . . 10.0 111.441 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.0 p -76.74 -20.39 56.57 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.908 0.385 . . . . 10.0 111.219 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.67 -11.18 62.42 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.005 -0.617 . . . . 10.0 111.948 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.786 -1.008 . . . . 10.0 111.275 -179.808 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 55.9 t30 . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.775 0.322 . . . . 10.0 110.77 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . 0.502 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 59.7 t30 -120.24 124.38 45.53 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 109.364 -0.606 . . . . 10.0 109.364 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 24.5 ptt180 -124.2 128.24 48.92 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.42 0.629 . . . . 10.0 111.321 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -120.66 130.33 24.9 Favored Pre-proline 0 C--N 1.318 -0.791 0 N-CA-C 107.569 -1.271 . . . . 10.0 107.569 177.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -108.79 130.59 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.232 0 C-N-CA 121.948 1.765 . . . . 10.0 113.456 -178.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 2.6 mt -117.67 136.44 54.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 113.967 -1.47 . . . . 10.0 109.705 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 60.3 t -113.42 133.01 60.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 N-CA-C 109.109 -0.7 . . . . 10.0 109.109 -179.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 6.3 tp -114.98 144.23 22.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-N 114.628 -1.169 . . . . 10.0 110.948 -176.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . 0.426 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 2.0 t70 -110.71 130.11 55.66 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.287 -0.87 . . . . 10.0 112.093 -173.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo . . . . . 0 C--O 1.251 1.152 0 C-N-CA 122.46 2.107 . . . . 10.0 111.488 178.648 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 . . . . . 0 N--CA 1.477 0.881 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 11.6 mm -112.79 123.28 68.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.432 -0.581 . . . . 10.0 109.432 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.492 ' HB3' ' HZ3' ' A' ' 23' ' ' LYS . 6.7 ttpm? -100.18 113.7 26.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.953 0.406 . . . . 10.0 111.207 -179.298 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 80.3 mt -101.26 140.07 36.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.803 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.0 mtpt -101.77 110.44 22.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.758 0.313 . . . . 10.0 110.766 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.435 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 7.1 t -88.1 123.48 40.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 108.915 -0.772 . . . . 10.0 108.915 178.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.8 mm -92.82 111.95 25.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 120.956 0.408 . . . . 10.0 111.473 -178.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.26 156.8 29.85 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 111.314 -0.715 . . . . 10.0 111.314 178.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 48.2 tp60 -64.88 -22.18 66.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.886 0.374 . . . . 10.0 110.992 -179.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.428 ' CG ' ' HG ' ' A' ' 32' ' ' SER . 4.4 p30 -93.98 17.52 12.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.962 0.41 . . . . 10.0 110.819 179.53 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.2 m 62.98 45.8 5.16 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.721 -0.672 . . . . 10.0 111.415 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.428 ' HG ' ' CG ' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -92.3 128.74 38.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.959 179.2 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.441 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 3.6 mp0 -92.34 88.06 6.28 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.513 0.673 . . . . 10.0 110.255 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.435 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 12.7 mm -80.97 128.63 38.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.617 -0.72 . . . . 10.0 111.929 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -103.7 89.82 3.46 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.143 -0.688 . . . . 10.0 109.143 178.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -92.61 109.54 20.96 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.774 -0.371 . . . . 10.0 110.86 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -88.48 97.28 10.99 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.4 m -98.34 168.15 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.885 -179.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 54.1 tttt -118.43 135.33 54.42 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.261 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 45.3 tpp -80.26 77.46 7.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.088 0.471 . . . . 10.0 110.885 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.8 t 177.95 -37.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.222 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.7 148.79 28.8 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.142 179.436 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 13.5 m80 -68.9 153.46 43.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.597 0.237 . . . . 10.0 110.743 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 34.7 mt -69.31 -15.86 63.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.506 -0.315 . . . . 10.0 111.136 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 36.2 tttp -59.25 -46.67 87.88 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.928 -0.397 . . . . 10.0 109.928 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.492 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.5 tppp? -58.7 -32.04 68.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.559 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -74.62 -39.33 62.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.626 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -62.86 -52.5 62.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.899 -0.592 . . . . 10.0 111.789 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -64.4 -31.74 73.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.582 -0.281 . . . . 10.0 111.461 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 53.9 m -72.92 -34.95 66.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.754 0.311 . . . . 10.0 110.918 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -65.98 -36.06 82.29 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.933 0.397 . . . . 10.0 110.14 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 56.6 m -61.95 -40.27 94.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.947 -0.569 . . . . 10.0 109.782 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -66.45 -31.94 73.0 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.54 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.45 HH21 ' CG ' ' B' ' 360' ' ' ASP . 16.9 tpt180 -68.48 -39.74 81.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.871 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -85.51 -16.71 38.65 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.476 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.63 37.93 13.02 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.817 -0.706 . . . . 10.0 112.398 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 9.1 m -133.61 155.41 80.57 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 110.224 -0.288 . . . . 10.0 110.224 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -70.03 167.69 24.07 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.251 1.967 . . . . 10.0 111.373 179.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.7 ttt -74.19 163.52 27.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.608 0.242 . . . . 10.0 110.572 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.2 t30 74.74 0.58 3.6 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.367 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.3 p -86.56 -46.87 9.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.124 0.488 . . . . 10.0 110.036 179.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.2 mt -99.55 131.02 45.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.866 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.514 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 13.2 ptt180 -110.3 128.71 55.67 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.79 179.148 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -88.5 130.27 35.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.937 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.7 mt -113.81 126.22 54.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.067 0.46 . . . . 10.0 110.397 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -135.62 117.32 15.01 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.624 -0.716 . . . . 10.0 109.926 -179.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 62.74 18.51 10.71 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.761 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.91 -18.73 49.0 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.604 -0.808 . . . . 10.0 112.911 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -98.31 157.77 15.98 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.621 -0.34 . . . . 10.0 110.639 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -96.2 131.26 42.85 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.339 -0.391 . . . . 10.0 110.308 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 48.8 mm -66.68 121.03 15.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.609 -0.723 . . . . 10.0 111.556 -179.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.95 168.26 13.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.57 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.463 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -75.67 -18.5 59.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.217 0.532 . . . . 10.0 110.479 179.759 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -96.29 11.44 34.59 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.946 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -90.01 145.7 24.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.235 0.541 . . . . 10.0 111.558 -179.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 34.9 p -118.07 155.24 51.52 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.539 -0.755 . . . . 10.0 109.172 178.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_exo -68.96 -7.55 21.09 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.518 2.146 . . . . 10.0 112.805 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -86.51 -33.5 20.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.42 -0.354 . . . . 10.0 111.235 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.426 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 11.2 pt-20 -85.48 174.91 9.15 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.619 -0.432 . . . . 10.0 110.006 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 87.6 mt 73.04 -59.46 0.57 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.318 0.647 . . . . 10.0 110.701 -179.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 132.07 61.63 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.592 -0.813 . . . . 10.0 113.033 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 49.5 mtt -98.42 133.59 42.59 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.354 -0.239 . . . . 10.0 110.354 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.2 mm-40 -132.62 -176.96 4.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.183 0.516 . . . . 10.0 111.436 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -70.06 140.1 52.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.154 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 63.95 27.62 14.38 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 123.526 0.516 . . . . 10.0 111.231 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -74.07 171.12 14.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.04 0.448 . . . . 10.0 111.397 -179.432 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.5 t -121.12 132.73 69.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.898 -178.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 20.5 tt -138.89 140.88 37.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 110.165 -0.309 . . . . 10.0 110.165 179.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -103.35 156.17 17.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.699 -179.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.4 p -143.27 127.27 14.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.112 0.482 . . . . 10.0 110.219 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -136.66 165.23 26.38 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.971 -0.558 . . . . 10.0 110.039 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -90.38 136.81 32.82 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 110.353 -0.239 . . . . 10.0 110.353 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.514 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.1 mm-40 -67.66 164.94 18.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.709 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -68.64 -26.94 65.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.082 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 34.1 p -74.7 -30.86 61.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.36 0.6 . . . . 10.0 110.769 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.98 20.4 67.89 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.208 -0.757 . . . . 10.0 111.208 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.671 -1.072 . . . . 10.0 111.302 -179.596 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 64.2 t30 . . . . . 0 N--CA 1.482 1.153 0 CA-C-O 121.364 0.602 . . . . 10.0 110.492 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . 0.422 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 42.5 t30 -119.15 123.09 43.53 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.265 -1.013 . . . . 10.0 108.265 179.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . 0.441 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 13.5 ptt180 -124.14 125.4 44.41 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 120.156 -0.617 . . . . 10.0 111.053 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . 0.45 ' CG ' HH21 ' A' ' 54' ' ' ARG . 30.9 t0 -124.13 130.18 24.47 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 107.544 -1.28 . . . . 10.0 107.544 176.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -108.18 129.51 0.05 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.516 0 C-N-CA 121.969 1.779 . . . . 10.0 111.848 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 10.6 mt -117.35 136.75 53.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 114.695 -1.139 . . . . 10.0 110.276 -178.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 11.4 t -112.17 135.69 50.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.984 -178.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . 0.492 HD11 ' HG3' ' A' ' 46' ' ' LYS . 8.7 tp -113.05 145.19 19.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 114.878 -1.055 . . . . 10.0 111.439 -176.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -114.77 130.81 56.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.847 -1.07 . . . . 10.0 111.94 -175.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . 0.476 ' P ' ' HZ2' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo . . . . . 0 C--O 1.244 0.819 0 C-N-CA 123.094 2.529 . . . . 10.0 112.375 -179.718 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 . . . . . 0 N--CA 1.477 0.905 0 N-CA-C 110.162 -0.31 . . . . 10.0 110.162 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.4 mm -109.68 119.17 58.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 109.408 -0.59 . . . . 10.0 109.408 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.499 ' HB3' ' HZ3' ' A' ' 23' ' ' LYS . 6.8 ttpm? -96.28 108.65 21.17 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.19 0.519 . . . . 10.0 110.835 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.8 mt -98.3 136.58 38.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.573 179.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 78.3 mttt -97.56 112.84 24.54 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.138 0.494 . . . . 10.0 110.596 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.4 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.8 t -91.95 135.24 27.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.153 -179.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 32.6 mm -90.72 108.39 19.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.619 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.422 ' HA3' ' OG ' ' A' ' 32' ' ' SER . . . -80.71 150.33 31.03 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.809 -0.71 . . . . 10.0 112.043 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -64.08 -22.67 67.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.846 0.355 . . . . 10.0 111.516 -179.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -96.49 26.73 4.21 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.717 0.294 . . . . 10.0 110.92 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 29.5 m 60.63 45.06 10.76 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.502 0.667 . . . . 10.0 110.864 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.422 ' OG ' ' HA3' ' A' ' 28' ' ' GLY . 3.8 p -106.65 149.48 27.19 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.395 -0.821 . . . . 10.0 110.608 -179.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 28.1 tt0 -108.73 97.34 7.0 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.228 -0.656 . . . . 10.0 109.228 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.423 HG21 HD12 ' A' ' 34' ' ' ILE . 0.8 OUTLIER -86.23 126.24 40.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.658 -178.928 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.8 m170 -101.99 96.79 7.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.114 0.483 . . . . 10.0 109.946 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -89.32 109.98 20.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.923 -0.581 . . . . 10.0 110.425 -179.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -89.72 91.56 8.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.321 179.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.405 ' HA ' ' CG2' ' B' ' 364' ' ' ILE . 5.1 m -100.93 -174.54 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.761 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -135.11 143.85 46.83 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.955 -0.387 . . . . 10.0 109.955 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.444 ' C ' ' HG1' ' A' ' 41' ' ' THR . 60.8 tpp -78.42 60.83 2.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.408 0.623 . . . . 10.0 110.555 -179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.444 ' HG1' ' C ' ' A' ' 40' ' ' MET . 28.2 m -161.69 -38.76 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.605 -0.725 . . . . 10.0 109.597 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.59 153.61 38.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.482 -0.781 . . . . 10.0 111.628 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -80.07 151.48 29.86 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.387 -0.824 . . . . 10.0 110.019 179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 74.7 mt -72.07 -10.63 60.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.743 0.306 . . . . 10.0 110.758 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -59.91 -46.68 88.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.981 178.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.9 tppp? -62.99 -41.0 99.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.411 -0.813 . . . . 10.0 110.778 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.07 -41.58 94.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.915 -178.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -58.79 -47.56 84.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.285 -0.416 . . . . 10.0 112.015 -179.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -74.39 -38.22 63.18 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.717 -0.393 . . . . 10.0 111.674 -179.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 63.5 m -59.56 -34.01 72.14 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.888 0.375 . . . . 10.0 110.744 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -69.78 -41.66 74.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.332 -0.395 . . . . 10.0 109.937 178.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.552 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 79.4 m -62.1 -43.38 98.95 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.327 -0.397 . . . . 10.0 109.939 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -63.37 -36.38 83.53 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.215 0.531 . . . . 10.0 110.175 179.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -65.32 -40.33 93.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.404 179.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -77.68 -22.73 50.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.07 -0.513 . . . . 10.0 110.949 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.43 24.96 29.56 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.326 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.5 m -124.07 154.43 68.13 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 110.394 -0.225 . . . . 10.0 110.394 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -61.18 153.05 67.65 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.473 2.116 . . . . 10.0 111.608 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.552 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 17.2 ttt -65.82 152.38 44.51 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 121.232 -0.187 . . . . 10.0 110.889 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.5 t30 82.53 -3.78 1.38 Allowed 'General case' 0 N--CA 1.472 0.644 0 O-C-N 124.175 0.922 . . . . 10.0 111.681 179.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.4 p -79.0 -24.35 43.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.202 0.525 . . . . 10.0 110.326 179.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.1 mt -117.82 131.48 56.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.124 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.428 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 16.6 ptt-85 -104.1 138.27 40.84 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.322 179.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.401 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 73.4 m-85 -100.41 127.26 46.78 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.139 -0.482 . . . . 10.0 109.924 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt -112.17 117.09 31.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.048 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -117.52 107.19 13.98 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.291 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 59.1 34.29 23.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.092 0.472 . . . . 10.0 111.02 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.61 -3.11 87.31 Favored Glycine 0 CA--C 1.518 0.262 0 CA-C-N 115.849 -0.614 . . . . 10.0 113.103 179.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -106.7 128.51 54.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.871 0.336 . . . . 10.0 110.494 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 13.9 ptm180 -76.25 126.66 31.39 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.074 0.464 . . . . 10.0 110.532 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.4 mm -66.78 123.6 20.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.577 -0.738 . . . . 10.0 110.953 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -84.74 170.9 12.79 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.674 -0.693 . . . . 10.0 110.787 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.48 5.54 17.46 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.96 -0.564 . . . . 10.0 111.147 -179.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -130.32 18.16 5.41 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.708 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.3 m170 -88.94 159.46 17.64 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.07 0.462 . . . . 10.0 111.114 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.476 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -131.34 153.47 81.65 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.595 -0.729 . . . . 10.0 110.075 179.678 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.2 -17.82 55.08 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.393 2.062 . . . . 10.0 112.325 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -70.68 -36.67 73.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.925 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 76' ' ' THR . 11.2 pt-20 -85.87 167.23 15.34 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.434 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 84.9 mt 73.79 -51.36 0.69 Allowed 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.208 0.603 . . . . 10.0 110.63 -179.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 117.02 61.41 0.31 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.006 -0.616 . . . . 10.0 113.022 178.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 44.4 mtt -87.32 125.05 33.99 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.759 0.314 . . . . 10.0 110.311 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.497 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 7.4 mm-40 -123.74 177.6 5.63 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.135 0.493 . . . . 10.0 111.336 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.421 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 21.7 tp10 -70.25 142.09 52.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.706 179.407 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.412 ' HG2' ' HG3' ' A' ' 84' ' ' GLU . 70.2 mm-40 68.23 25.06 7.31 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 123.464 0.477 . . . . 10.0 111.039 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.497 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.1 t70 -76.52 162.16 28.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.523 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 95.4 t -117.17 125.52 73.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.869 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 19.4 tt -129.4 137.55 56.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.061 -0.518 . . . . 10.0 109.959 179.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -103.49 149.56 24.73 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.898 0.38 . . . . 10.0 111.536 -178.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -132.06 130.89 61.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.835 -0.621 . . . . 10.0 109.808 179.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -134.77 157.62 46.28 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.761 0.315 . . . . 10.0 111.138 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -75.4 129.73 37.82 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.679 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.428 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 3.1 mm-40 -79.15 152.65 30.6 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.742 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -77.05 0.15 22.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.707 -0.679 . . . . 10.0 111.433 -178.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.4 p -88.31 -27.86 21.42 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.086 0.469 . . . . 10.0 110.525 179.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.09 16.3 80.66 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.674 -179.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.945 -0.919 . . . . 10.0 110.965 -179.589 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 29.6 t30 . . . . . 0 N--CA 1.483 1.177 0 CA-C-O 120.458 0.171 . . . . 10.0 110.886 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -120.19 119.83 34.37 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 119.703 -0.799 . . . . 10.0 109.451 178.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . 0.503 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 18.4 ptt180 -130.01 129.76 44.12 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.377 0.51 . . . . 10.0 112.377 179.06 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . 0.424 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 23.8 t70 -121.85 129.96 24.94 Favored Pre-proline 0 C--N 1.316 -0.867 0 N-CA-C 107.31 -1.367 . . . . 10.0 107.31 175.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 71.7 Cg_endo -108.37 129.11 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.107 0 C-N-CA 121.651 1.567 . . . . 10.0 112.581 -179.072 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 7.4 mt -117.84 136.36 55.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 114.182 -1.372 . . . . 10.0 110.735 -177.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 99.3 t -114.28 135.2 54.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 108.509 -0.923 . . . . 10.0 108.509 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . 0.43 HD13 ' HA ' ' B' ' 364' ' ' ILE . 8.3 tp -114.16 147.22 17.81 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 114.818 -1.083 . . . . 10.0 112.261 -176.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -114.46 129.95 56.69 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.927 -1.033 . . . . 10.0 111.211 -175.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . 0.409 ' HA ' ' HD3' ' B' ' 368' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' B' ' 367' ' ' SEP . 21.8 Cg_exo . . . . . 0 C--O 1.246 0.882 0 C-N-CA 123.142 2.562 . . . . 10.0 111.516 179.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 N--CA 1.481 1.08 0 CA-C-O 120.84 0.353 . . . . 10.0 110.624 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.8 mm -122.44 117.05 50.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 179.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.549 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.9 ttpm? -93.15 119.49 32.41 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.132 0.491 . . . . 10.0 111.021 -179.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 59.2 mt -102.27 142.38 33.59 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.762 -0.654 . . . . 10.0 110.096 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.3 mtpt -100.12 100.91 11.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.958 0.409 . . . . 10.0 110.481 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.604 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.3 t -86.17 118.01 31.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.8 mm -97.18 112.65 29.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.025 0.441 . . . . 10.0 111.511 -178.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.26 160.09 37.89 Favored Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 110.901 -0.88 . . . . 10.0 110.901 178.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -66.74 -19.35 65.73 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.911 0.355 . . . . 10.0 111.354 -179.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.39 27.65 3.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.52 -0.309 . . . . 10.0 111.047 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.0 m 62.28 33.79 16.35 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.51 179.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.58 110.14 22.27 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.459 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.4 ' OE1' ' N ' ' B' ' 357' ' ' ASN . 8.7 mt-10 -91.79 98.94 11.92 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.252 -0.647 . . . . 10.0 109.252 178.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.414 HD13 HG21 ' A' ' 34' ' ' ILE . 5.1 mm -87.04 127.82 40.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.467 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.434 ' ND1' ' HE3' ' A' ' 23' ' ' LYS . 14.7 m-70 -103.46 85.66 2.51 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -89.92 119.12 30.02 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.566 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -90.91 101.41 14.17 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.136 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 m -97.57 172.1 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.777 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.422 ' HD3' ' CB ' ' B' ' 366' ' ' ASP . 77.9 tttt -123.51 141.31 52.13 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.819 -0.437 . . . . 10.0 109.819 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.503 ' SD ' ' HB2' ' A' ' 77' ' ' PRO . 41.4 tpp -78.26 54.23 1.35 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.078 0.466 . . . . 10.0 111.548 -179.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 52.7 m -154.64 -45.15 0.09 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.221 179.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.45 ' OG1' ' HB2' ' B' ' 366' ' ' ASP . 0.3 OUTLIER -73.32 153.05 40.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.693 179.85 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -79.25 155.82 28.38 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.005 -0.739 . . . . 10.0 109.005 179.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 78.3 mt -69.81 -8.22 46.42 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.78 0.324 . . . . 10.0 111.172 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 47.8 tptt -58.98 -49.47 77.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.989 -0.551 . . . . 10.0 109.98 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.417 ' HZ3' ' P ' ' B' ' 365' ' ' SEP . 5.9 tppp? -59.64 -41.55 90.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.34 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.46 -40.22 95.28 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.418 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -63.95 -45.31 89.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.321 -0.4 . . . . 10.0 112.053 -179.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -73.7 -39.29 64.46 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.668 -0.413 . . . . 10.0 111.536 -179.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.464 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 67.6 m -64.92 -32.47 74.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.825 0.345 . . . . 10.0 111.09 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -65.62 -38.46 89.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.057 0.456 . . . . 10.0 110.391 179.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.499 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 60.2 m -63.01 -36.07 82.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.714 -0.676 . . . . 10.0 110.138 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.464 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 74.2 mt-30 -67.91 -34.18 76.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.802 -0.635 . . . . 10.0 110.515 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -67.43 -38.44 84.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.578 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -80.89 -34.48 33.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.309 -179.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 99.97 37.13 3.98 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.69 -0.767 . . . . 10.0 112.168 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.428 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 2.5 m -137.1 155.82 75.89 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 109.984 -0.376 . . . . 10.0 109.984 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -69.17 155.19 68.65 Favored 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.18 1.92 . . . . 10.0 111.382 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.499 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 11.9 ttt -64.09 158.02 23.87 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 121.097 -0.241 . . . . 10.0 111.176 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.6 t30 81.03 -0.48 1.76 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.75 0.82 . . . . 10.0 111.461 179.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 57.1 p -86.25 -29.5 23.06 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.17 0.509 . . . . 10.0 110.441 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 25.0 mt -119.06 140.47 50.01 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.795 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.48 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 21.4 ptt-85 -117.44 141.59 48.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.159 179.225 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -96.83 129.72 44.22 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.138 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt -107.58 116.07 31.29 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.963 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -124.68 113.31 17.82 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 61.56 32.55 18.64 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 123.484 0.49 . . . . 10.0 110.964 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.67 -13.79 57.61 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.018 -0.61 . . . . 10.0 113.104 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -100.27 147.35 25.85 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.913 0.387 . . . . 10.0 110.651 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -89.33 126.69 35.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.004 0.43 . . . . 10.0 110.523 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 42.9 mm -63.77 125.26 20.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.568 -0.742 . . . . 10.0 111.191 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.64 -179.25 7.27 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.946 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 1.5 m-20 -88.92 -2.6 58.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.49 -0.323 . . . . 10.0 111.338 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -119.37 12.07 12.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.683 0.278 . . . . 10.0 111.142 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -84.16 153.89 23.42 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.112 0.482 . . . . 10.0 111.722 -179.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.427 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 35.6 p -124.73 157.48 65.77 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.55 -0.75 . . . . 10.0 109.636 178.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.503 ' HB2' ' SD ' ' A' ' 40' ' ' MET . 14.9 Cg_exo -69.23 -12.54 34.15 Favored 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 122.382 2.055 . . . . 10.0 112.692 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -77.07 -41.24 43.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.641 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 10.6 pt-20 -77.94 160.17 28.39 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 179.243 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 33.9 mt 73.69 -43.65 0.55 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.506 0.504 . . . . 10.0 110.379 -178.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.408 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 105.18 74.72 0.96 Allowed Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.965 -0.636 . . . . 10.0 113.55 178.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 36.6 mtt -96.74 131.74 43.15 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.688 -0.486 . . . . 10.0 109.688 178.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.538 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.3 mm-40 -129.9 179.01 6.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.939 0.4 . . . . 10.0 111.47 -179.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.549 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 20.7 tp10 -69.0 142.41 54.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.587 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 66.39 19.89 10.96 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 123.687 0.617 . . . . 10.0 111.249 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.538 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.8 OUTLIER -69.78 138.73 52.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.29 -0.413 . . . . 10.0 110.144 179.96 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.7 t -93.82 120.03 42.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.859 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.604 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 18.3 tt -133.28 139.48 49.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 179.387 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -112.15 154.28 25.73 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.901 0.382 . . . . 10.0 111.114 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.7 p -128.53 136.21 60.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.802 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -135.59 157.14 47.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.583 0.23 . . . . 10.0 110.823 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -74.41 136.61 42.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.553 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.48 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 6.1 mm-40 -71.39 161.54 30.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.905 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -65.37 -34.04 77.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.827 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.3 p -69.96 -30.2 67.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.002 0.43 . . . . 10.0 110.704 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.27 3.42 87.14 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 121.048 -0.596 . . . . 10.0 111.933 -179.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.961 0 CA-C-O 118.745 -1.031 . . . . 10.0 111.13 -179.889 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . 0.4 ' N ' ' OE1' ' A' ' 33' ' ' GLU . 4.8 p-10 . . . . . 0 N--CA 1.483 1.192 0 N-CA-C 111.395 0.146 . . . . 10.0 111.395 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -119.88 123.76 44.39 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 109.033 -0.729 . . . . 10.0 109.033 179.049 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -125.49 126.47 44.94 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.963 0.727 . . . . 10.0 112.963 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . 0.448 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 39.2 t70 -126.67 127.42 24.49 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 175.538 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 61.4 Cg_endo -110.92 126.03 0.03 OUTLIER 'Trans proline' 0 CA--C 1.536 0.593 0 C-N-CA 121.926 1.75 . . . . 10.0 113.414 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 3.4 mt -122.97 136.73 58.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 114.908 -1.042 . . . . 10.0 110.409 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 43.4 t -113.54 135.66 52.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.014 0.435 . . . . 10.0 110.006 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 7.1 tp -112.33 145.25 18.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.242 -0.89 . . . . 10.0 111.428 -176.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . 0.417 ' P ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . 0.45 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 7.3 t70 -114.56 132.45 56.33 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.252 -1.34 . . . . 10.0 111.046 -176.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo . . . . . 0 C--O 1.251 1.172 0 C-N-CA 122.973 2.448 . . . . 10.0 112.164 -179.529 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 109.709 -0.478 . . . . 10.0 109.709 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.491 ' O ' HG22 ' A' ' 38' ' ' VAL . 34.1 mm -73.35 112.25 9.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.954 0.407 . . . . 10.0 110.553 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.497 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -97.18 101.11 12.61 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.102 0.477 . . . . 10.0 110.114 179.601 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 69.9 mt -82.89 157.54 23.04 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.738 -0.664 . . . . 10.0 110.37 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.459 ' HA ' ' O ' ' A' ' 34' ' ' ILE . 77.8 tttt -120.94 109.03 14.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.938 0.399 . . . . 10.0 110.675 179.437 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.451 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 3.2 t -92.23 128.05 44.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 179.108 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.1 mm -107.22 122.44 61.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.897 0.379 . . . . 10.0 111.068 -179.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -100.78 167.85 20.08 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.756 179.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -65.74 -16.14 63.5 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.231 0.538 . . . . 10.0 110.994 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.2 p-10 -92.24 18.41 8.28 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.254 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.2 m 58.08 42.78 21.88 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.413 0.625 . . . . 10.0 110.96 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -90.75 149.32 22.06 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.322 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.52 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 42.5 mt-10 -116.91 86.95 2.6 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.249 -0.649 . . . . 10.0 109.249 178.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.459 ' O ' ' HA ' ' A' ' 25' ' ' LYS . 44.2 mm -79.04 118.69 26.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.151 -179.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 20.6 m170 -102.16 89.29 3.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.947 -0.76 . . . . 10.0 108.947 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -92.03 116.0 28.55 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.854 -178.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -90.44 97.88 11.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.035 -0.529 . . . . 10.0 109.587 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.491 HG22 ' O ' ' A' ' 22' ' ' ILE . 2.8 m -100.77 170.42 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.61 -179.488 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.1 tttt -122.33 141.07 51.93 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.404 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 62.3 tpp -79.37 75.14 5.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.559 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -176.92 -41.8 0.01 OUTLIER 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.383 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.591 ' OG1' ' HB2' ' B' ' 366' ' ' ASP . 0.2 OUTLIER -76.93 147.49 36.93 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.764 179.772 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.7 m80 -75.61 153.37 37.33 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 53.6 mt -69.93 -4.97 22.96 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.752 0.31 . . . . 10.0 111.324 -179.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 46.2 tptt -61.36 -48.79 79.66 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -62.91 -35.23 79.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.276 -0.874 . . . . 10.0 110.256 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.77 -46.97 70.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.683 -0.69 . . . . 10.0 111.031 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -60.57 -44.16 96.49 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.998 -0.546 . . . . 10.0 112.11 -179.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -70.81 -41.93 70.92 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.97 -0.292 . . . . 10.0 111.655 -178.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.9 m -64.47 -32.47 74.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.705 0.288 . . . . 10.0 111.222 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -68.77 -35.02 76.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.848 0.356 . . . . 10.0 110.24 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.48 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 85.6 m -62.37 -40.02 95.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.181 0.515 . . . . 10.0 109.927 179.211 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -67.36 -30.73 70.61 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.364 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -68.27 -30.0 68.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.221 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -98.48 -4.95 33.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.319 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.63 36.88 62.03 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.878 -0.677 . . . . 10.0 112.54 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 13.4 m -130.5 152.53 80.49 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 110.067 -0.346 . . . . 10.0 110.067 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -69.82 158.16 57.81 Favored 'Trans proline' 0 N--CA 1.466 -0.13 0 C-N-CA 122.256 1.971 . . . . 10.0 111.443 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.48 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 12.0 ttt -66.74 157.65 32.25 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.959 -0.296 . . . . 10.0 110.348 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.9 t30 79.06 -5.88 1.95 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.483 0.713 . . . . 10.0 111.46 179.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.4 p -81.72 -24.16 36.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.855 0.359 . . . . 10.0 110.832 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 79.2 mt -119.02 143.36 47.12 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.907 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.497 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 16.5 ptt-85 -116.18 128.14 55.38 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.172 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -90.8 128.31 36.66 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.05 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.7 mt -111.01 131.22 55.23 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.62 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -143.03 117.41 9.64 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.56 -0.745 . . . . 10.0 109.97 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 61.07 29.66 19.05 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.782 -0.645 . . . . 10.0 111.883 179.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.41 -4.77 85.89 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.71 -0.757 . . . . 10.0 112.784 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -112.78 156.2 23.27 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.187 -0.301 . . . . 10.0 110.187 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -95.66 134.96 37.96 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.072 0.463 . . . . 10.0 110.679 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 37.3 mm -71.79 115.88 12.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.478 -0.783 . . . . 10.0 110.321 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.41 167.05 21.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.169 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.59 11.17 2.18 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.765 -178.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -133.56 11.96 4.09 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.107 0.479 . . . . 10.0 110.325 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -81.93 151.7 27.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.521 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.423 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 31.9 p -125.02 153.46 71.27 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.003 179.18 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -66.96 -12.51 36.39 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 122.461 2.107 . . . . 10.0 112.454 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -75.8 -35.82 59.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.706 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 76' ' ' THR . 9.9 pt-20 -91.25 170.26 10.15 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.827 -0.434 . . . . 10.0 109.827 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mt 72.63 -49.79 0.7 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.261 0.625 . . . . 10.0 110.999 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.82 76.26 0.59 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 121.022 -0.608 . . . . 10.0 112.496 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 34.9 mtt -106.52 123.77 48.59 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.997 -0.372 . . . . 10.0 109.997 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.532 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 5.1 mm-40 -122.17 178.87 4.74 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.307 0.575 . . . . 10.0 112.013 -179.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.497 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 28.3 tp10 -67.7 137.58 55.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.462 -0.79 . . . . 10.0 109.945 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 65.3 27.79 11.99 Favored 'General case' 0 N--CA 1.464 0.249 0 O-C-N 123.61 0.569 . . . . 10.0 111.112 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.532 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.6 t0 -77.0 142.08 40.08 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.305 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 29.6 t -91.45 120.88 41.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.055 -0.521 . . . . 10.0 111.37 -179.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 15.3 tt -129.49 142.78 43.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 108.954 -0.758 . . . . 10.0 108.954 178.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -119.14 153.61 34.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.029 0.442 . . . . 10.0 111.449 -178.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.9 p -135.73 133.84 51.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.851 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -134.04 164.3 27.64 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.617 -0.265 . . . . 10.0 110.677 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -72.87 134.31 44.78 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.481 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.497 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 0.7 OUTLIER -72.08 164.48 26.08 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.231 179.931 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -68.06 -36.45 79.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.502 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.0 p -71.18 -30.26 66.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.11 0.481 . . . . 10.0 111.008 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.73 5.4 89.88 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.579 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.829 -0.984 . . . . 10.0 111.012 -179.802 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 22.0 m120 . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.512 0.196 . . . . 10.0 111.228 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . 0.52 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 54.5 t30 -119.6 119.62 34.31 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 177.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . 0.493 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 14.1 ptt85 -126.59 129.58 48.82 Favored 'General case' 0 CA--C 1.506 -0.722 0 C-N-CA 119.857 -0.737 . . . . 10.0 112.094 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . 0.431 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 31.7 t70 -121.8 132.48 24.23 Favored Pre-proline 0 C--N 1.311 -1.09 0 N-CA-C 107.298 -1.371 . . . . 10.0 107.298 177.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 58.5 Cg_endo -106.81 129.69 0.05 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.438 0 C-N-CA 121.914 1.742 . . . . 10.0 112.328 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 9.5 mt -118.97 136.92 54.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 113.884 -1.507 . . . . 10.0 110.774 -178.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 52.6 t -113.39 135.07 54.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.295 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 9.3 tp -112.55 144.66 19.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 114.951 -1.022 . . . . 10.0 110.546 -176.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . 0.591 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 0.2 OUTLIER -116.47 132.28 56.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 113.853 -1.521 . . . . 10.0 112.601 -174.791 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . 0.523 ' HD3' ' O ' ' B' ' 366' ' ' ASP . 7.2 Cg_endo . . . . . 0 C--O 1.246 0.917 0 C-N-CA 122.812 2.341 . . . . 10.0 111.925 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 110.178 -0.304 . . . . 10.0 110.178 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.7 mm -112.82 117.51 55.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.778 -0.453 . . . . 10.0 109.778 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.465 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.7 OUTLIER -97.06 102.95 14.84 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.138 0.494 . . . . 10.0 110.796 -179.463 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 45.3 mt -82.79 146.96 28.67 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.872 -0.604 . . . . 10.0 109.808 179.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.7 ttpt -110.95 99.54 8.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.011 0.434 . . . . 10.0 109.986 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.42 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.9 t -78.16 133.05 31.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.929 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 15.4 mm -92.1 110.29 22.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.902 -179.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.437 ' HA3' ' OG ' ' A' ' 32' ' ' SER . . . -83.0 160.49 38.8 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.625 -0.798 . . . . 10.0 112.053 179.208 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -64.02 -31.97 73.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.791 0.329 . . . . 10.0 111.334 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -92.03 25.85 2.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.055 0.455 . . . . 10.0 110.468 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.1 m 63.4 32.95 14.17 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.502 -0.772 . . . . 10.0 111.003 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.437 ' OG ' ' HA3' ' A' ' 28' ' ' GLY . 0.3 OUTLIER -84.9 129.94 34.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.526 -0.761 . . . . 10.0 109.989 179.397 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -97.99 94.83 7.08 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.591 -0.522 . . . . 10.0 109.591 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.42 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 4.6 mm -77.9 121.75 31.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.209 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.6 m170 -101.97 89.24 3.57 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.276 -0.42 . . . . 10.0 109.88 -179.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.473 ' CE2' HD11 ' B' ' 362' ' ' ILE . 0.1 OUTLIER -96.29 118.48 32.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.296 -179.663 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -91.57 102.02 14.67 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.387 -0.369 . . . . 10.0 110.174 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.2 m -100.4 170.94 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.587 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -123.16 135.44 54.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.063 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 60.8 tpp -75.49 74.39 2.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.038 -179.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.0 t 178.25 -30.96 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.481 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.68 153.27 22.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.895 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -75.78 150.47 37.75 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.114 179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 34.8 mt -70.0 -9.96 56.99 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.327 -0.397 . . . . 10.0 111.494 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.9 tptt -59.78 -47.18 86.74 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 178.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.507 ' HZ2' ' P ' ' B' ' 367' ' ' SEP . 5.6 tppp? -60.49 -29.74 69.26 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.65 -0.705 . . . . 10.0 110.59 179.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.404 HD11 ' HA ' ' A' ' 47' ' ' LEU . 3.8 mm? -79.66 -41.07 27.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.229 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -65.56 -35.36 80.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.268 -0.424 . . . . 10.0 111.111 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.413 ' OE2' ' HG3' ' A' ' 59' ' ' MET . 2.6 mm-40 -71.38 -43.85 66.09 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.103 -179.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.3 p -66.57 -37.8 85.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.685 -178.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -59.86 -45.13 93.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.698 0.285 . . . . 10.0 110.454 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.439 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.3 m -60.45 -42.63 96.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.049 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -63.68 -38.45 91.15 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.45 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 -65.38 -36.74 84.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.398 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -76.04 -20.59 57.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.969 -0.559 . . . . 10.0 110.375 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 86.53 26.99 31.13 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.787 -0.642 . . . . 10.0 112.525 179.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.2 m -131.93 158.82 74.44 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 110.453 -0.203 . . . . 10.0 110.453 -179.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.23 166.01 18.08 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.452 2.101 . . . . 10.0 112.02 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.439 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 0.2 OUTLIER -72.2 159.39 34.19 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.907 -179.621 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 t30 69.31 13.81 8.52 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.328 0.651 . . . . 10.0 111.49 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 38.9 p -89.2 -22.69 22.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.255 0.55 . . . . 10.0 109.776 178.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 mt -127.7 142.24 51.38 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.482 -0.781 . . . . 10.0 110.591 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.7 ptt-85 -112.05 130.65 55.8 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.013 -0.539 . . . . 10.0 110.024 179.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.48 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 98.0 m-85 -90.65 131.99 36.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.439 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 93.7 mt -113.97 120.11 39.53 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.14 0.495 . . . . 10.0 111.03 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -127.24 112.73 15.44 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.554 -0.906 . . . . 10.0 108.554 179.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 65.65 25.6 11.56 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.089 0.471 . . . . 10.0 110.265 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.92 -14.77 62.45 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.753 -0.658 . . . . 10.0 112.749 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -98.85 148.07 24.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.776 0.322 . . . . 10.0 110.809 -179.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.48 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 14.2 ptm180 -85.3 132.19 34.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.964 0.411 . . . . 10.0 110.519 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 41.8 mm -71.24 127.1 32.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.224 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.3 -173.7 3.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.647 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -93.22 -33.36 14.01 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.035 0.445 . . . . 10.0 110.698 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -90.3 4.91 49.34 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.779 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -73.57 147.11 44.21 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.637 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.543 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -124.97 151.22 68.51 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.876 179.479 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -62.65 -15.86 49.06 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.527 2.151 . . . . 10.0 112.413 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -64.92 -41.92 95.14 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.285 179.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.543 ' HG2' ' O ' ' A' ' 76' ' ' THR . 7.7 pt-20 -89.11 171.67 9.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.806 -0.634 . . . . 10.0 109.599 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 18.3 mt 73.23 -49.49 0.69 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.689 0.618 . . . . 10.0 111.139 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.39 76.57 0.83 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 121.101 -0.571 . . . . 10.0 112.27 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 43.9 mtt -106.43 125.67 51.29 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.718 0.294 . . . . 10.0 110.38 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.495 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.2 mm-40 -124.75 178.61 5.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.04 0.448 . . . . 10.0 111.235 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.465 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 19.2 tp10 -67.86 138.67 56.25 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.476 179.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 64.51 26.34 13.37 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 123.614 0.571 . . . . 10.0 111.429 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.495 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -71.17 155.6 40.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.421 179.919 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 57.3 t -99.15 120.82 49.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.135 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 11.4 tt -136.45 136.59 48.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.225 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -113.07 159.25 19.38 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.795 0.331 . . . . 10.0 111.081 -179.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.3 p -142.16 131.19 22.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.425 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -131.16 158.69 39.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.402 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -71.24 138.0 49.09 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.82 0.343 . . . . 10.0 110.937 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -75.08 160.78 30.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.857 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -64.9 -42.65 94.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.991 -0.549 . . . . 10.0 110.313 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.97 -40.71 96.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.571 -0.74 . . . . 10.0 111.5 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 99.8 -16.23 58.78 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.825 -0.702 . . . . 10.0 112.458 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.001 0 CA-C-O 119.174 -0.792 . . . . 10.0 111.551 -179.946 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 65.4 t30 . . . . . 0 N--CA 1.487 1.413 0 CA-C-O 121.028 0.442 . . . . 10.0 110.79 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -120.88 121.35 37.9 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.291 -1.003 . . . . 10.0 108.291 178.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 23.9 ptt180 -127.51 130.14 48.65 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 112.454 0.538 . . . . 10.0 112.454 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . 0.469 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 31.0 t70 -120.12 128.79 25.66 Favored Pre-proline 0 C--N 1.317 -0.842 0 N-CA-C 105.632 -1.988 . . . . 10.0 105.632 175.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 48.8 Cg_endo -108.64 127.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.237 0 C-N-CA 121.542 1.494 . . . . 10.0 113.688 -177.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . 0.473 HD11 ' CE2' ' A' ' 36' ' ' PHE . 1.7 mt -121.19 134.54 64.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 114.147 -1.388 . . . . 10.0 110.182 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 77.8 t -114.68 136.43 51.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.18 -0.674 . . . . 10.0 109.18 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . 0.439 HD11 ' HG3' ' A' ' 46' ' ' LYS . 7.9 tp -111.92 148.26 15.21 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-N 114.766 -1.107 . . . . 10.0 111.316 -176.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -112.6 130.88 55.87 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.896 -1.047 . . . . 10.0 111.705 -174.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . 0.507 ' P ' ' HZ2' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' B' ' 367' ' ' SEP . 19.3 Cg_exo . . . . . 0 C--O 1.249 1.045 0 C-N-CA 122.835 2.357 . . . . 10.0 111.496 179.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 . . . . . 0 N--CA 1.479 1.021 0 CA-C-O 120.692 0.282 . . . . 10.0 110.271 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.0 mm -122.78 108.4 21.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.496 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.7 OUTLIER -94.82 106.17 18.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.218 0.532 . . . . 10.0 110.677 -179.667 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 30.5 mt -90.76 146.92 23.58 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.231 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.9 mtpt -109.44 105.51 14.89 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.932 -0.395 . . . . 10.0 109.932 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.461 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.5 t -86.7 131.4 34.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.739 179.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.5 mm -84.83 104.41 12.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.278 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -72.25 152.13 47.87 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.82 -0.705 . . . . 10.0 112.172 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -61.2 -28.97 69.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.823 0.345 . . . . 10.0 110.981 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -96.14 23.94 6.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.754 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 m 64.77 34.41 9.5 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.089 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.2 p -92.47 142.5 27.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.475 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.446 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 24.4 mt-10 -98.12 102.34 14.06 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.947 -0.39 . . . . 10.0 109.947 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.461 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 9.1 mm -87.49 117.04 30.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.332 -0.395 . . . . 10.0 110.331 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -97.03 92.62 6.16 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.856 -0.424 . . . . 10.0 109.856 179.553 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.34 108.03 20.48 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.993 -0.373 . . . . 10.0 109.993 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -88.28 102.26 14.66 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.795 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -101.84 167.51 2.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.119 -0.492 . . . . 10.0 111.091 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 67.6 tttt -115.82 133.06 56.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.004 -0.544 . . . . 10.0 109.559 179.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.484 ' O ' ' HB ' ' A' ' 41' ' ' THR . 59.5 tpp -75.47 80.33 2.51 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.363 -0.38 . . . . 10.0 111.127 -179.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.484 ' HB ' ' O ' ' A' ' 40' ' ' MET . 14.7 t 172.04 -27.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.371 179.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.7 150.69 26.59 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.861 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.3 m80 -71.09 144.89 50.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.363 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.0 mt -67.71 -12.8 61.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.966 0.412 . . . . 10.0 110.293 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.8 tptt -57.91 -47.93 81.39 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.794 178.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.478 ' HZ3' ' P ' ' B' ' 365' ' ' SEP . 4.9 tppp? -62.57 -33.56 75.2 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.178 -0.919 . . . . 10.0 110.708 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -71.33 -37.48 71.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.873 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -68.87 -46.6 68.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.773 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.431 ' OE1' ' HA ' ' A' ' 46' ' ' LYS . 14.8 pt-20 -66.68 -43.41 84.55 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.586 0.217 . . . . 10.0 111.586 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.429 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 19.3 m -64.15 -33.47 75.85 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.809 0.3 . . . . 10.0 111.809 -179.164 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -65.06 -42.7 93.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.791 0.329 . . . . 10.0 110.298 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.419 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 39.6 m -61.81 -39.46 91.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.183 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.429 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.4 mt-30 -63.68 -36.92 85.42 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.359 179.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -67.38 -37.51 83.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.546 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -79.67 -13.74 59.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.943 -0.571 . . . . 10.0 111.003 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.59 27.92 56.18 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.254 -0.498 . . . . 10.0 112.687 179.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.5 m -129.25 151.27 77.49 Favored Pre-proline 0 C--N 1.328 -0.365 0 O-C-N 122.663 -0.316 . . . . 10.0 110.698 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.84 151.73 75.18 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.504 2.136 . . . . 10.0 111.678 179.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.419 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 19.4 ttt -63.81 159.24 19.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.495 -0.321 . . . . 10.0 111.058 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.6 t30 78.18 4.07 2.77 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.662 0.785 . . . . 10.0 111.751 179.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.3 p -92.43 -20.21 21.25 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.874 0.369 . . . . 10.0 111.017 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.1 mt -116.75 136.54 52.88 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.279 -0.418 . . . . 10.0 111.245 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.441 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 28.0 ptt-85 -105.91 131.49 53.15 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.909 179.152 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -99.13 119.56 38.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.833 -0.621 . . . . 10.0 109.777 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.7 mt -108.73 114.89 29.06 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.239 0.542 . . . . 10.0 111.385 -178.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -123.18 118.8 28.47 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.368 -0.975 . . . . 10.0 108.368 178.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 64.66 20.16 12.05 Favored 'General case' 0 N--CA 1.464 0.231 0 O-C-N 123.544 0.527 . . . . 10.0 110.342 -178.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.93 -13.12 68.1 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 115.755 -0.657 . . . . 10.0 112.719 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -98.17 150.84 21.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.822 0.344 . . . . 10.0 111.016 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.404 HH12 ' HD2' ' A' ' 70' ' ' ARG . 11.7 ptm180 -88.97 124.73 34.53 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.432 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.1 mm -66.04 126.73 25.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.614 -0.721 . . . . 10.0 111.022 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -84.15 -179.88 7.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.621 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.21 -5.94 57.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.901 0.381 . . . . 10.0 111.099 -179.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -113.38 14.7 19.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.995 0.426 . . . . 10.0 110.666 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 20.1 m170 -87.16 158.31 19.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.397 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.534 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 10.6 p -134.13 154.71 80.26 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.435 -0.802 . . . . 10.0 109.399 178.77 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.02 -9.59 25.57 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.352 2.035 . . . . 10.0 112.121 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -71.6 -34.19 69.66 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.6 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 76' ' ' THR . 5.5 pt-20 -92.78 171.99 8.63 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.006 -0.368 . . . . 10.0 110.006 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.7 mt 73.13 -44.45 0.59 Allowed 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.829 0.706 . . . . 10.0 111.051 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.4 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 107.87 60.53 0.56 Allowed Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 121.228 -0.511 . . . . 10.0 111.96 179.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 47.9 mtt -87.63 126.62 35.06 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.031 -0.359 . . . . 10.0 110.031 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 18.0 mm-40 -130.51 178.59 6.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.335 0.588 . . . . 10.0 112.136 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.496 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 20.3 tp10 -67.85 137.69 55.5 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.323 -0.853 . . . . 10.0 110.333 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 5.9 mm-40 69.46 26.64 5.13 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.615 0.572 . . . . 10.0 111.607 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.3 OUTLIER -80.98 146.87 30.49 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.956 -0.387 . . . . 10.0 109.956 179.343 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 98.5 t -100.64 127.67 53.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.206 -0.452 . . . . 10.0 111.0 -179.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.4 tt -132.2 146.63 32.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.654 -0.498 . . . . 10.0 109.654 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -110.34 152.22 26.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.848 0.356 . . . . 10.0 111.48 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 10.6 p -141.12 130.0 24.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.932 179.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -135.62 164.29 28.17 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.493 -0.322 . . . . 10.0 110.385 -179.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -83.4 132.07 35.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.771 0.319 . . . . 10.0 110.584 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.441 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.8 mm-40 -72.72 156.12 39.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.013 -0.54 . . . . 10.0 111.55 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -70.22 -22.0 62.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.492 -0.776 . . . . 10.0 111.273 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.9 p -77.34 -19.5 56.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.933 0.397 . . . . 10.0 111.241 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 74.19 10.71 81.73 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.741 -0.742 . . . . 10.0 111.642 -179.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.93 0 CA-C-O 118.65 -1.083 . . . . 10.0 111.202 -179.709 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 64.7 t30 . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 121.046 0.45 . . . . 10.0 110.76 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 358' ' ' ASN . . . . . 0.446 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 52.8 t30 -119.15 121.42 39.71 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 108.189 -1.041 . . . . 10.0 108.189 178.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 359' ' ' ARG . . . . . 0.412 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 24.9 ptt180 -128.73 130.22 46.81 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.642 0.608 . . . . 10.0 112.642 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 360' ' ' ASP . . . . . 0.435 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 32.9 t70 -119.87 131.49 24.39 Favored Pre-proline 0 C--N 1.318 -0.769 0 N-CA-C 107.018 -1.475 . . . . 10.0 107.018 175.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 361' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 68.5 Cg_endo -109.63 128.95 0.04 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 121.775 1.65 . . . . 10.0 113.911 -178.109 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 3.0 mt -118.1 135.72 57.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 114.316 -1.311 . . . . 10.0 110.1 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 59.0 t -114.68 136.61 50.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 108.889 -0.782 . . . . 10.0 108.889 -179.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 364' ' ' ILE . . . . . 0.406 HD11 ' HG3' ' A' ' 46' ' ' LYS . 6.4 tp -111.85 145.11 18.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 115.354 -0.839 . . . . 10.0 112.149 -175.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 365' ' ' SEP . . . . . 0.478 ' P ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -111.85 129.64 56.09 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.847 -1.07 . . . . 10.0 111.707 -174.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_exo . . . . . 0 C--O 1.245 0.833 0 C-N-CA 122.956 2.438 . . . . 10.0 111.366 179.558 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 . . . . . 0 N--CA 1.479 1.0 0 CA-C-O 120.714 0.292 . . . . 10.0 110.517 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 32.4 mm -105.81 126.62 61.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.124 -0.489 . . . . 10.0 109.774 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.427 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.4 ttpm? -99.56 97.74 8.69 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.088 0.471 . . . . 10.0 110.546 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 69.5 mt -84.77 144.84 28.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.334 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.5 mtpt -102.53 107.78 18.86 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.932 0.396 . . . . 10.0 110.696 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.43 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 3.0 t -91.05 122.07 42.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 109.078 -0.712 . . . . 10.0 109.078 178.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 39.1 mm -91.15 108.59 20.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 120.933 0.397 . . . . 10.0 111.158 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.97 158.03 49.28 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.767 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 -63.71 -22.09 66.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.63 0.252 . . . . 10.0 111.556 -178.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -103.41 28.63 6.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.794 0.33 . . . . 10.0 111.42 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.7 m 65.69 27.53 11.29 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.693 -0.685 . . . . 10.0 112.243 178.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.29 125.8 35.25 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.558 -0.534 . . . . 10.0 109.558 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -97.5 102.54 14.33 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.19 0.519 . . . . 10.0 110.627 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.43 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 2.9 mm -89.67 129.83 39.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.522 -179.22 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.2 m170 -103.7 94.82 5.65 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -91.09 116.02 28.48 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.371 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -86.56 99.65 11.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.179 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.458 HG12 HD11 ' A' ' 47' ' ' LEU . 3.4 m -104.06 171.48 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.936 -179.212 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 49.5 tttm -127.41 140.02 52.44 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.493 ' SD ' ' HB2' ' A' ' 77' ' ' PRO . 43.9 tpp -75.55 63.68 1.55 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.226 0.536 . . . . 10.0 110.609 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.9 m -161.42 -40.14 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.676 -0.693 . . . . 10.0 109.663 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.2 163.36 27.14 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.32 -0.854 . . . . 10.0 111.983 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -90.47 153.62 20.25 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.182 -0.917 . . . . 10.0 109.768 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.5 mt -72.72 -10.6 59.99 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.163 -0.215 . . . . 10.0 111.146 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 30.8 tptt -60.36 -47.31 86.63 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.281 -0.637 . . . . 10.0 109.281 177.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -62.92 -37.2 86.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.144 -0.935 . . . . 10.0 110.486 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.458 HD11 HG12 ' A' ' 38' ' ' VAL . 3.3 mm? -69.14 -45.31 70.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.319 -179.584 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -60.01 -47.15 87.02 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.222 -0.445 . . . . 10.0 112.063 -179.08 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -69.27 -37.69 78.02 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 121.051 -0.259 . . . . 10.0 111.584 -178.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.452 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 45.8 m -66.09 -35.65 81.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.852 0.358 . . . . 10.0 111.391 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -66.65 -35.49 80.29 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.495 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 64.5 m -63.86 -35.24 79.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.953 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.452 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 64.2 mt-30 -71.02 -33.71 70.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.178 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.64 -32.99 74.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.599 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -92.15 -29.29 16.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.264 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 97.1 33.08 6.14 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 120.741 -0.742 . . . . 10.0 112.442 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.8 m -128.39 156.96 76.09 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 110.262 -0.273 . . . . 10.0 110.262 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -68.87 156.54 65.08 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.125 1.884 . . . . 10.0 111.197 179.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.495 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 12.1 ttt -67.02 156.43 36.05 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.962 -0.295 . . . . 10.0 110.38 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.4 t30 79.78 -0.27 2.14 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 123.932 0.77 . . . . 10.0 111.697 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 76.0 p -85.89 -27.84 24.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.141 0.496 . . . . 10.0 110.089 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 63.1 mt -112.31 129.83 56.16 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.744 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.474 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.6 ptt-85 -100.86 129.97 46.81 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.798 179.213 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -96.82 117.86 32.0 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.5 mt -103.66 124.55 49.04 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.336 0.588 . . . . 10.0 111.128 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -127.51 105.38 8.46 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.186 -0.915 . . . . 10.0 109.227 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 65.54 25.13 11.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.459 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.98 -11.37 65.98 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.927 -0.654 . . . . 10.0 112.958 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -101.4 148.62 24.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.782 0.291 . . . . 10.0 110.285 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 70' ' ' ARG . 9.6 ptm180 -89.3 131.43 35.4 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.99 0.424 . . . . 10.0 110.376 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 45.7 mm -69.89 120.91 18.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.217 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -85.19 169.19 14.08 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.326 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.409 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 38.7 m-20 -72.62 -30.75 64.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.905 0.383 . . . . 10.0 111.237 -179.353 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 18.1 p-10 -91.23 9.38 31.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.877 0.37 . . . . 10.0 111.146 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.407 ' HB2' ' O ' ' A' ' 72' ' ' ALA . 1.4 m170 -74.94 148.97 39.56 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.107 0.48 . . . . 10.0 110.765 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.606 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -133.59 145.42 56.22 Favored Pre-proline 0 C--N 1.32 -0.689 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.082 179.33 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 77' ' ' PRO . . . . . 0.493 ' HB2' ' SD ' ' A' ' 40' ' ' MET . 31.6 Cg_exo -59.04 -13.27 18.3 Favored 'Trans proline' 0 N--CA 1.477 0.522 0 C-N-CA 122.834 2.356 . . . . 10.0 112.991 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -73.7 -27.57 61.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.558 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.606 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.0 pt-20 -98.65 172.45 7.47 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.694 -0.484 . . . . 10.0 109.694 179.513 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 31.5 mt 72.26 -55.9 0.66 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.685 0.616 . . . . 10.0 110.989 -179.498 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 121.27 66.42 0.25 Allowed Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 121.076 -0.583 . . . . 10.0 112.377 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 60.6 mtt -96.78 137.4 35.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.555 0.217 . . . . 10.0 110.497 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.475 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 2.4 mm-40 -138.04 -173.04 3.4 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.042 0.449 . . . . 10.0 111.307 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.427 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 24.6 tp10 -73.67 140.58 46.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.001 -0.545 . . . . 10.0 109.909 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 68.25 23.59 7.75 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.604 0.565 . . . . 10.0 110.682 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.5 t0 -72.18 152.53 42.2 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.071 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 41.3 t -107.19 122.66 61.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.439 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.9 tt -126.27 134.34 66.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -103.34 145.92 29.24 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.771 0.32 . . . . 10.0 111.312 -178.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -126.99 125.31 66.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.115 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -130.19 157.31 42.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.608 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -82.97 131.74 35.17 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.101 -0.333 . . . . 10.0 110.101 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.474 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.2 mm-40 -78.92 154.54 29.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.66 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -70.51 -14.83 62.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.96 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.5 p -74.43 -25.42 59.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.759 179.587 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.84 -9.59 44.02 Favored Glycine 0 C--N 1.332 0.328 0 CA-C-N 115.919 -0.582 . . . . 10.0 112.107 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.799 -1.001 . . . . 10.0 110.928 -179.339 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 7.0 t30 . . . . . 0 N--CA 1.483 1.203 0 CA-C-O 121.07 0.462 . . . . 10.0 110.62 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 57.2 t-20 -118.08 124.71 48.74 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 109.052 -0.722 . . . . 10.0 109.052 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -122.98 128.26 49.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.225 0.536 . . . . 10.0 111.554 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 360' ' ' ASP . . . . . 0.436 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 18.5 t0 -122.19 130.2 24.8 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 108.376 -0.972 . . . . 10.0 108.376 178.016 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 361' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 59.9 Cg_endo -109.13 127.56 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.115 0 C-N-CA 121.275 1.317 . . . . 10.0 113.904 -179.128 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 2.0 mt -119.96 136.89 55.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 113.815 -1.539 . . . . 10.0 109.192 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 3.1 t -113.95 135.79 52.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-O 121.659 0.742 . . . . 10.0 109.861 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 3.6 tp . . . . . 0 C--N 1.314 -0.936 0 CA-C-N 114.248 -1.342 . . . . 10.0 111.326 -176.874 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 . . . . . 0 N--CA 1.483 1.219 0 CA-C-O 120.468 0.175 . . . . 10.0 110.588 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 38.1 mm -114.1 116.0 51.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.436 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.2 ttpm? -99.95 106.53 18.34 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.986 0.422 . . . . 10.0 110.451 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 31.2 mt -90.99 150.92 21.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.648 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.5 mtpt -107.16 109.68 21.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.283 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.451 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.4 t -92.6 126.59 45.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 179.223 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 27.3 mm -94.8 112.22 26.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.978 0.418 . . . . 10.0 110.992 -179.319 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.25 160.66 35.03 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.776 -0.647 . . . . 10.0 112.028 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.9 tp60 -63.08 -32.82 74.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.044 0.387 . . . . 10.0 112.044 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -88.9 25.66 1.74 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.777 0.322 . . . . 10.0 111.52 -179.126 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.6 m 65.66 42.58 3.56 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.251 0.548 . . . . 10.0 111.13 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.6 p -101.82 135.11 43.92 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.276 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -108.49 96.39 6.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.272 0.558 . . . . 10.0 109.495 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.451 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 7.2 mm -79.99 129.67 37.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.682 -0.69 . . . . 10.0 111.261 -178.579 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -101.32 86.23 2.95 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.624 -0.717 . . . . 10.0 109.654 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.27 117.77 30.47 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.506 -0.478 . . . . 10.0 110.167 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -93.22 104.11 16.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.401 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.4 m -103.54 170.49 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.341 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -123.12 135.72 54.49 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.272 -0.27 . . . . 10.0 110.272 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.55 ' O ' ' HB ' ' A' ' 41' ' ' THR . 62.3 tpp -74.13 76.24 1.76 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.437 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.55 ' HB ' ' O ' ' A' ' 40' ' ' MET . 12.0 t 170.39 -24.86 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.334 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.79 151.95 24.0 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.188 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -74.03 144.27 45.17 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.762 -0.653 . . . . 10.0 110.099 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 58.7 mt -75.0 -4.19 36.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.003 0.43 . . . . 10.0 110.616 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.3 tptt -58.17 -50.86 72.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.627 -0.715 . . . . 10.0 109.549 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.425 ' HG3' HD11 ' B' ' 364' ' ' ILE . 4.0 tppp? -63.21 -39.14 93.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.765 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -62.29 -43.37 98.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.072 -0.513 . . . . 10.0 111.582 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -62.62 -45.39 93.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.29 -0.414 . . . . 10.0 112.082 -179.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -73.52 -35.78 65.63 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.0 -0.28 . . . . 10.0 111.715 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.0 m -64.72 -30.81 71.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.952 0.406 . . . . 10.0 110.807 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -69.14 -36.23 77.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.102 0.477 . . . . 10.0 109.796 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.568 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.3 m -63.5 -37.1 86.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.179 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -63.55 -34.61 78.17 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.399 179.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -69.85 -37.93 76.31 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.573 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -79.88 -18.29 51.04 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.796 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.34 24.62 62.97 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.933 -0.651 . . . . 10.0 112.018 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.417 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 18.3 m -124.93 155.92 69.75 Favored Pre-proline 0 C--N 1.325 -0.46 0 N-CA-C 110.618 -0.142 . . . . 10.0 110.618 -179.339 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -65.18 154.62 72.62 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.553 2.169 . . . . 10.0 111.993 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.568 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 17.2 ttt -67.5 157.91 33.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.853 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 33.5 t30 79.21 4.16 2.29 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.767 0.827 . . . . 10.0 111.656 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -93.29 -20.61 20.24 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.126 0.489 . . . . 10.0 109.994 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 43.2 mt -116.81 137.81 51.94 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.771 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.49 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 20.1 ptt-85 -107.44 132.04 53.62 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.258 179.131 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -95.72 115.56 27.6 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.5 mt -105.52 112.5 25.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.065 0.459 . . . . 10.0 110.717 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -117.86 110.63 18.0 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.343 179.296 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 61.51 28.62 17.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.464 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.18 -21.43 46.05 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.9 -0.667 . . . . 10.0 113.815 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -99.06 150.96 21.47 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 117.269 0.535 . . . . 10.0 111.192 -178.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.2 ptm85 -87.09 134.68 33.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.157 0.503 . . . . 10.0 110.565 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.9 mm -75.25 125.48 34.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.998 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -85.32 168.79 14.36 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.301 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.81 -25.72 59.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.92 0.39 . . . . 10.0 110.872 -179.462 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -98.08 20.59 12.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.761 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.5 m170 -88.77 156.97 18.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.729 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.484 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 5.0 p -134.78 154.74 79.58 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.83 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -64.85 -15.01 48.21 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.382 2.055 . . . . 10.0 112.119 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -70.1 -40.37 74.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.817 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.4 pt-20 -85.54 167.9 14.99 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.818 -0.438 . . . . 10.0 109.818 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.1 mt 73.06 -53.04 0.71 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.108 0.563 . . . . 10.0 110.754 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.79 81.41 0.86 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.931 -0.652 . . . . 10.0 112.464 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.2 mtt -109.11 132.0 54.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.685 0.279 . . . . 10.0 110.286 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -128.66 -177.11 4.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.555 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.436 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 21.5 tp10 -74.89 137.03 41.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.446 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 68.89 28.19 5.38 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.675 0.609 . . . . 10.0 111.203 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.82 153.94 30.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.005 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 67.2 t -105.53 132.7 51.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.975 0.416 . . . . 10.0 111.744 -178.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.1 tt -136.95 143.36 35.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.088 -0.708 . . . . 10.0 109.088 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -110.69 149.82 29.92 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.951 0.405 . . . . 10.0 111.472 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.6 p -136.91 132.17 47.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.841 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -139.02 165.32 27.45 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.447 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -80.19 135.97 36.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.232 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.49 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.1 mm-40 -78.49 171.07 15.64 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.861 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -89.17 -5.59 57.61 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.108 0.48 . . . . 10.0 109.855 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.0 p -78.07 -67.76 0.7 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.68 -0.691 . . . . 10.0 111.123 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 130.13 -28.79 3.81 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.001 -0.619 . . . . 10.0 111.93 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.69 -1.061 . . . . 10.0 111.538 179.658 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 42.0 t30 . . . . . 0 N--CA 1.483 1.205 0 CA-C-O 120.962 0.41 . . . . 10.0 110.392 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -122.32 121.38 36.6 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.382 -0.97 . . . . 10.0 108.382 177.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -126.25 128.71 47.62 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.9 0.704 . . . . 10.0 112.9 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 360' ' ' ASP . . . . . 0.41 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 28.6 t70 -124.18 129.71 24.63 Favored Pre-proline 0 C--N 1.313 -0.989 0 N-CA-C 106.73 -1.581 . . . . 10.0 106.73 175.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 361' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 43.6 Cg_endo -109.84 127.92 0.04 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 121.843 1.696 . . . . 10.0 113.959 -178.147 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.9 mt -118.95 135.93 57.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 114.739 -1.119 . . . . 10.0 110.112 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 1.4 t -113.29 135.4 52.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.129 -0.487 . . . . 10.0 109.94 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 364' ' ' ILE . . . . . 0.425 HD11 ' HG3' ' A' ' 46' ' ' LYS . 6.1 tp . . . . . 0 C--N 1.316 -0.871 0 CA-C-N 114.964 -1.016 . . . . 10.0 110.929 -177.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 110.161 -0.311 . . . . 10.0 110.161 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.5 mm -113.86 125.83 71.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.368 -0.378 . . . . 10.0 109.983 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -96.46 105.16 17.2 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.083 0.468 . . . . 10.0 111.213 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 91.3 mt -90.6 140.85 29.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.905 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.2 mtpt -106.53 116.47 31.98 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.933 0.397 . . . . 10.0 111.135 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.509 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.8 t -101.98 123.84 55.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 37.7 mm -97.78 108.52 21.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.063 0.459 . . . . 10.0 110.832 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.29 170.9 54.31 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.678 -0.692 . . . . 10.0 112.014 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -70.63 -19.17 62.84 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.974 0.416 . . . . 10.0 110.898 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -96.38 21.66 8.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.454 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.3 m 61.97 37.47 14.98 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.476 -0.784 . . . . 10.0 111.136 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 p -90.18 138.93 31.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.126 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 2.0 mt-10 -104.7 94.05 5.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.095 0.474 . . . . 10.0 110.051 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.509 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 19.6 mm -80.84 121.64 34.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.027 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -103.01 88.05 3.07 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.518 -0.549 . . . . 10.0 109.518 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -91.01 114.58 27.14 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.405 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.6 ttmt -86.99 97.99 11.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.046 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.487 HG12 HD11 ' A' ' 47' ' ' LEU . 4.0 m -100.72 172.95 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.621 -179.393 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 tttt -124.55 135.6 53.29 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.82 -0.437 . . . . 10.0 109.82 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 56.8 tpp -74.61 78.64 1.99 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.891 0.377 . . . . 10.0 111.313 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 7.0 t 174.67 -32.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.336 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.22 148.43 33.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.888 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -72.16 148.96 45.13 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.407 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 80.1 mt -71.22 -6.51 40.19 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.997 0.427 . . . . 10.0 110.463 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.473 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 42.7 tptt -57.38 -52.86 63.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.752 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -60.79 -33.82 73.56 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.221 -0.9 . . . . 10.0 111.072 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.487 HD11 HG12 ' A' ' 38' ' ' VAL . 4.0 mm? -69.63 -44.98 69.54 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.223 -179.382 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 57.1 mtpt -61.13 -47.01 88.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.982 -178.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 6.5 pt-20 -68.06 -43.07 79.48 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.932 -0.307 . . . . 10.0 111.603 -179.074 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.1 m -62.7 -34.28 76.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.702 0.287 . . . . 10.0 111.199 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -66.6 -38.85 87.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.697 0.284 . . . . 10.0 110.291 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.578 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.5 m -63.47 -41.28 98.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 10.0 109.828 179.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -64.25 -36.61 84.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.328 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -63.02 -32.08 73.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.847 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -89.63 -31.13 17.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.718 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 106.96 -19.92 34.46 Favored Glycine 0 C--O 1.23 -0.135 0 C-N-CA 121.111 -0.566 . . . . 10.0 112.251 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.414 ' H ' HG22 ' A' ' 57' ' ' VAL . 5.0 m -77.29 155.5 81.93 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 110.543 -0.169 . . . . 10.0 110.543 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -62.11 168.03 9.83 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.479 2.12 . . . . 10.0 111.875 179.381 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.578 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 24.9 ttt -70.46 148.16 48.63 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.785 0.326 . . . . 10.0 111.45 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t30 73.52 6.78 5.09 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.124 -0.944 . . . . 10.0 112.501 178.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.3 p -76.73 -24.85 53.03 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.852 -0.795 . . . . 10.0 108.852 178.36 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 56.1 mt -115.15 132.24 56.67 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 114.863 -1.062 . . . . 10.0 109.757 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.54 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 13.2 ptt-85 -100.86 129.98 46.8 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.202 -0.453 . . . . 10.0 110.417 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.472 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 64.9 m-85 -91.42 119.1 31.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.018 179.496 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.8 mt -108.98 121.24 44.7 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.539 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -129.96 111.07 12.18 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.652 -0.703 . . . . 10.0 109.627 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 66.57 23.5 10.36 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.214 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.94 -8.23 70.32 Favored Glycine 0 N--CA 1.453 -0.195 0 C-N-CA 121.014 -0.612 . . . . 10.0 113.1 179.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -109.33 144.14 37.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.587 0.232 . . . . 10.0 110.668 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.472 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 11.9 ptm180 -84.01 133.83 34.66 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.173 0.511 . . . . 10.0 110.438 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.1 mm -71.68 125.02 29.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.878 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.02 167.22 19.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.09 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.39 -25.25 59.37 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.162 0.506 . . . . 10.0 110.719 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -96.13 13.74 26.24 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.791 -0.64 . . . . 10.0 111.073 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.9 m170 -85.35 152.52 23.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.149 0.5 . . . . 10.0 111.223 -179.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.515 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 35.4 p -124.43 155.58 68.58 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.95 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -70.94 -10.78 28.27 Favored 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.166 1.911 . . . . 10.0 112.19 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -77.76 -30.1 51.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.386 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.2 pt-20 -92.81 174.69 7.12 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.583 -0.525 . . . . 10.0 109.583 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 4.8 mt 72.89 -56.59 0.66 Allowed 'General case' 0 N--CA 1.469 0.503 0 O-C-N 123.548 0.53 . . . . 10.0 111.017 -179.46 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 126.16 66.12 0.17 Allowed Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 121.206 -0.521 . . . . 10.0 111.917 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 55.7 mtt -101.85 134.21 45.39 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.738 0.304 . . . . 10.0 110.367 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 0.3 OUTLIER -138.65 178.61 7.02 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.766 -179.848 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.429 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 13.4 tp10 -67.02 143.71 56.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.265 -0.425 . . . . 10.0 109.944 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 22.4 mm-40 70.4 22.24 5.36 Favored 'General case' 0 C--O 1.232 0.169 0 O-C-N 123.716 0.635 . . . . 10.0 111.732 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.3 OUTLIER -78.89 153.23 30.68 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.352 179.433 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 89.6 t -115.77 128.45 73.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.441 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.9 tt -124.49 144.61 33.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.434 -0.58 . . . . 10.0 109.434 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -105.38 144.84 31.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.849 0.357 . . . . 10.0 110.893 -178.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 9.8 p -135.81 129.86 48.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.987 0.422 . . . . 10.0 110.226 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -135.54 167.69 20.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.508 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -83.18 134.1 34.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.714 0.293 . . . . 10.0 111.145 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.54 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 3.0 mm-40 -74.14 152.42 39.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.396 179.491 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -70.3 -17.16 63.08 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.774 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.2 p -77.08 -25.12 51.97 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.191 0.519 . . . . 10.0 110.639 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.25 -3.81 86.59 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.933 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.822 -0.988 . . . . 10.0 111.295 -179.732 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 65.9 t30 . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 121.014 0.435 . . . . 10.0 110.595 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 358' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 54.1 t30 -121.77 122.24 39.05 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.532 -0.914 . . . . 10.0 108.532 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 359' ' ' ARG . . . . . 0.481 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 23.2 ptt180 -126.0 128.7 47.87 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 119.791 -0.764 . . . . 10.0 112.035 179.258 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 360' ' ' ASP . . . . . 0.406 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 28.2 t70 -120.8 130.87 24.65 Favored Pre-proline 0 C--N 1.316 -0.864 0 N-CA-C 106.8 -1.556 . . . . 10.0 106.8 177.407 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 361' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 58.4 Cg_endo -108.07 128.61 0.05 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.524 0 C-N-CA 121.481 1.454 . . . . 10.0 113.179 -178.401 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.2 mt -119.27 136.99 54.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 114.128 -1.396 . . . . 10.0 109.734 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 48.7 t -113.25 135.21 53.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.269 0.557 . . . . 10.0 109.59 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 7.1 tp . . . . . 0 C--N 1.317 -0.82 0 CA-C-N 114.854 -1.067 . . . . 10.0 110.594 -177.132 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.5 mm -113.02 124.43 69.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 110.002 -0.37 . . . . 10.0 110.002 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.403 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 2.8 ttpm? -102.38 112.98 25.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.032 0.444 . . . . 10.0 110.385 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.1 mt -98.07 135.49 39.68 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.307 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -95.34 113.45 25.12 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.671 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.537 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.5 t -96.41 128.42 47.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.745 -0.662 . . . . 10.0 109.584 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.3 mm -101.54 109.49 25.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 120.838 0.352 . . . . 10.0 110.747 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -76.74 174.09 54.27 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 121.027 -0.606 . . . . 10.0 112.626 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 13.8 tp60 -69.92 -29.91 67.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.81 0.338 . . . . 10.0 111.662 -179.168 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -104.96 40.6 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.062 0.458 . . . . 10.0 111.17 -179.303 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.7 m 57.9 36.0 25.87 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.692 -0.686 . . . . 10.0 111.328 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.65 94.42 9.85 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.691 -0.686 . . . . 10.0 109.929 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.644 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 20.6 mt-10 -78.64 104.9 9.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.086 0.47 . . . . 10.0 109.784 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.1 mm -95.57 136.79 25.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.28 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 45.9 m-70 -110.97 95.33 5.48 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.512 -0.551 . . . . 10.0 109.512 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.04 121.28 34.22 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.356 -0.383 . . . . 10.0 110.499 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -89.17 107.4 19.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.809 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.407 HG12 HD11 ' A' ' 47' ' ' LEU . 4.4 m -110.27 171.05 3.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.969 0.414 . . . . 10.0 110.94 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 75.4 tttt -122.33 140.56 52.52 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.538 ' O ' ' HB ' ' A' ' 41' ' ' THR . 51.6 tpp -74.94 74.9 2.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.745 0.307 . . . . 10.0 111.449 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.538 ' HB ' ' O ' ' A' ' 40' ' ' MET . 14.5 t 169.82 -24.91 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.559 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -75.99 149.6 37.58 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.887 0.375 . . . . 10.0 110.934 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 25.4 m170 -78.36 138.31 38.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.003 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.1 mt -65.69 -16.17 63.5 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.528 -0.305 . . . . 10.0 111.46 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.44 ' HD2' ' HB3' ' A' ' 73' ' ' ASP . 34.7 tttp -60.31 -42.9 96.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.012 0.434 . . . . 10.0 109.91 178.772 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -65.58 -30.72 71.49 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.034 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.407 HD11 HG12 ' A' ' 38' ' ' VAL . 4.4 mm? -74.56 -49.13 23.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.626 -0.715 . . . . 10.0 111.094 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -56.61 -46.8 80.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.567 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -65.21 -40.37 94.05 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.282 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 65.9 m -67.41 -34.66 77.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.311 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -63.37 -40.84 98.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.995 0.426 . . . . 10.0 109.869 179.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 39.0 m -62.73 -42.21 99.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.767 179.115 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -64.76 -30.41 71.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.646 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -72.52 -45.15 60.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.033 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -76.56 -14.12 60.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.409 -0.36 . . . . 10.0 111.01 -179.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.71 37.17 17.41 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.864 -0.684 . . . . 10.0 112.178 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.6 m -130.42 155.4 81.08 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-O 120.511 0.196 . . . . 10.0 110.547 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -66.22 163.95 29.82 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 122.176 1.917 . . . . 10.0 111.92 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 12.1 tpt -70.62 150.68 45.78 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 110.065 -0.346 . . . . 10.0 110.065 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.0 t30 73.75 5.99 4.9 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.105 0.562 . . . . 10.0 112.166 179.014 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 80.4 p -84.0 -23.29 31.05 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.145 0.497 . . . . 10.0 110.351 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 43.7 mt -121.21 147.21 45.92 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.428 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.441 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 18.0 ptt-85 -116.9 134.24 55.01 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.243 -0.435 . . . . 10.0 109.963 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.415 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 86.0 m-85 -95.9 128.29 42.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.091 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 90.7 mt -112.23 125.89 54.64 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.229 0.538 . . . . 10.0 111.369 -179.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -137.59 118.51 14.25 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.537 -0.912 . . . . 10.0 108.537 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 66.23 19.6 11.07 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.218 0.532 . . . . 10.0 110.494 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.16 -4.84 84.61 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.221 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -105.39 145.46 30.77 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.189 -0.3 . . . . 10.0 110.189 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.415 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 12.1 ptm180 -85.0 125.76 32.98 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.089 0.471 . . . . 10.0 110.214 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 43.6 mm -63.98 123.58 17.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.313 -0.858 . . . . 10.0 111.52 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.07 166.22 15.19 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.203 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.44 ' HB3' ' HD2' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -73.89 -19.15 60.79 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.995 0.426 . . . . 10.0 111.378 -179.389 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -97.06 17.22 17.53 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.117 -0.492 . . . . 10.0 111.045 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -99.94 153.03 19.5 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.051 0.453 . . . . 10.0 111.129 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.424 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 57.5 p -131.63 162.82 53.9 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 108.961 -0.755 . . . . 10.0 108.961 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -69.99 -5.91 17.47 Favored 'Trans proline' 0 CA--C 1.53 0.317 0 C-N-CA 122.33 2.02 . . . . 10.0 112.16 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.64 -30.38 61.61 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.683 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.49 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 1.4 pt-20 -101.38 171.56 7.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.162 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 7.5 mt 73.26 -49.0 0.69 Allowed 'General case' 0 N--CA 1.469 0.498 0 O-C-N 123.699 0.624 . . . . 10.0 111.285 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 113.53 76.27 0.73 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.83 -0.7 . . . . 10.0 112.443 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 58.1 mtt -105.76 122.46 46.12 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.837 0.351 . . . . 10.0 110.265 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.533 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 5.4 mm-40 -120.97 -178.75 3.82 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.949 -179.269 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.403 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 15.9 tp10 -70.74 144.03 51.06 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 179.133 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 67.04 23.54 9.7 Favored 'General case' 0 N--CA 1.462 0.171 0 O-C-N 123.523 0.514 . . . . 10.0 110.904 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.533 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.8 OUTLIER -75.6 148.51 38.75 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.862 -0.421 . . . . 10.0 109.862 179.788 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 94.8 t -107.13 119.57 56.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.038 0.447 . . . . 10.0 111.446 -178.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.537 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 15.6 tt -118.49 136.36 55.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -103.07 150.65 23.39 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.84 0.352 . . . . 10.0 110.975 -178.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.6 p -136.43 131.43 48.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.012 179.507 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -135.02 159.87 40.14 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.411 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -73.49 136.92 44.2 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.505 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.441 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 1.3 mm-40 -73.5 159.62 32.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.697 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -72.98 -24.79 60.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.191 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.8 p -78.28 -34.27 49.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.214 0.53 . . . . 10.0 110.899 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.31 12.92 77.84 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.925 -0.87 . . . . 10.0 110.925 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.947 0 CA-C-O 118.876 -0.958 . . . . 10.0 111.283 -179.642 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 . . . . . 0 N--CA 1.48 1.025 0 CA-C-O 121.347 0.594 . . . . 10.0 110.168 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 358' ' ' ASN . . . . . 0.644 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 2.5 m-20 -120.17 125.88 49.3 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 108.454 -0.943 . . . . 10.0 108.454 179.035 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 22.3 ptt180 -125.84 122.05 35.02 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 119.378 -0.929 . . . . 10.0 113.019 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -128.46 127.27 23.64 Favored Pre-proline 0 C--N 1.316 -0.888 0 N-CA-C 107.536 -1.283 . . . . 10.0 107.536 174.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -110.78 126.34 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.154 0 C-N-CA 121.66 1.573 . . . . 10.0 113.086 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.7 mt -120.27 135.56 60.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.027 -0.988 . . . . 10.0 109.707 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 21.6 t -113.19 135.74 51.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.47 0.652 . . . . 10.0 109.721 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 364' ' ' ILE . . . . . 0.426 HD12 ' HA ' ' B' ' 364' ' ' ILE . 7.8 tp . . . . . 0 C--N 1.324 -0.522 0 CA-C-N 114.836 -1.075 . . . . 10.0 112.107 -176.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 . . . . . 0 N--CA 1.478 0.95 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.418 ' O ' HG22 ' A' ' 38' ' ' VAL . 39.1 mm -118.55 113.4 41.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.762 -0.459 . . . . 10.0 109.762 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.418 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 2.6 ttpm? -96.7 111.61 23.7 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.236 -0.438 . . . . 10.0 109.9 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 30.1 mt -94.03 150.87 19.95 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.4 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 38.0 mtpt -110.31 107.53 17.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.284 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.488 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 3.2 t -89.08 126.21 42.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.598 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.9 mm -93.54 115.87 33.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 120.984 0.421 . . . . 10.0 111.188 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.59 147.1 19.75 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 111.256 -0.738 . . . . 10.0 111.256 178.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -64.47 -21.14 66.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.778 0.323 . . . . 10.0 111.811 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -95.45 28.21 3.03 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 120.857 0.36 . . . . 10.0 111.021 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.1 m 61.0 66.42 0.9 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.588 0.708 . . . . 10.0 110.919 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.2 p -136.59 144.85 44.34 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.096 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -118.57 103.86 10.12 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.488 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 5.5 mm -88.77 119.74 36.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.197 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -96.93 96.53 8.58 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -97.3 112.86 24.49 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.398 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -86.73 103.13 14.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.977 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.418 HG22 ' O ' ' A' ' 22' ' ' ILE . 2.9 m -108.31 173.13 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.816 0.341 . . . . 10.0 110.675 -179.43 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.433 ' HD2' ' CG2' ' A' ' 41' ' ' THR . 23.4 ttmt -121.9 137.79 54.65 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.298 -0.63 . . . . 10.0 109.298 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.45 ' O ' ' HB ' ' A' ' 41' ' ' THR . 61.9 tpp -73.94 78.9 1.65 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.957 0.408 . . . . 10.0 110.598 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.45 ' HB ' ' O ' ' A' ' 40' ' ' MET . 15.3 t 174.09 -26.33 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.444 -0.798 . . . . 10.0 110.081 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.31 151.88 26.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.417 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.415 ' ND1' ' HB3' ' A' ' 45' ' ' LYS . 6.3 p80 -76.87 145.55 38.26 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.097 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.5 mt -71.83 -8.97 57.47 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.588 -0.278 . . . . 10.0 111.285 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.415 ' HB3' ' ND1' ' A' ' 43' ' ' HIS . 47.3 tptt -59.47 -48.2 82.57 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.061 0.458 . . . . 10.0 110.007 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.574 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.4 tppp? -62.85 -33.94 76.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.309 -0.859 . . . . 10.0 110.715 179.635 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.414 HD11 HG12 ' A' ' 38' ' ' VAL . 3.1 mm? -71.98 -44.24 63.83 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.286 -179.431 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -61.63 -42.6 99.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.297 -0.41 . . . . 10.0 111.399 -179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -72.34 -39.83 67.84 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 121.001 -0.28 . . . . 10.0 111.289 -179.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.437 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 66.4 m -63.45 -35.77 81.53 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.75 0.31 . . . . 10.0 111.411 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -64.32 -41.46 96.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.799 0.333 . . . . 10.0 110.177 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 57.2 m -62.3 -38.23 88.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.348 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.437 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.4 mt-30 -65.9 -42.9 89.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.79 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -61.75 -35.67 78.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.417 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -83.22 -16.82 45.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.849 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.31 35.58 42.25 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.094 -0.574 . . . . 10.0 112.535 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.3 m -131.37 155.55 81.34 Favored Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 110.24 -0.282 . . . . 10.0 110.24 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.34 159.57 39.18 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.358 2.039 . . . . 10.0 111.769 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 16.0 ttt -71.01 155.95 40.21 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 121.225 -0.19 . . . . 10.0 110.702 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 32.8 t30 76.65 -7.38 1.85 Allowed 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.542 0.737 . . . . 10.0 111.981 179.308 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.5 p -75.79 -19.45 58.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.226 0.536 . . . . 10.0 110.276 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.3 mt -116.97 135.27 53.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.253 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.433 ' HD3' ' OE2' ' A' ' 93' ' ' GLU . 7.1 ptt180 -111.34 119.96 40.61 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.145 0.498 . . . . 10.0 110.432 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -88.22 124.92 34.33 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.889 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 34.2 mt -114.5 124.86 52.97 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.044 0.449 . . . . 10.0 110.974 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -135.17 119.88 18.3 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.281 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 64.78 20.57 12.17 Favored 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.433 0.458 . . . . 10.0 111.136 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.71 2.45 81.75 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.912 -0.661 . . . . 10.0 112.302 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -114.76 145.06 42.52 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.749 -0.463 . . . . 10.0 109.749 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -80.98 142.19 33.69 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.975 0.417 . . . . 10.0 109.901 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.2 mm -79.28 121.17 31.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.427 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.7 169.47 18.18 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.505 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -81.71 -18.27 44.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.808 0.337 . . . . 10.0 111.085 -179.06 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -101.86 0.96 36.44 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.781 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 18.4 m170 -71.53 159.13 35.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.936 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.6 p -134.57 160.71 67.42 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.826 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -67.12 -14.66 44.15 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.454 2.103 . . . . 10.0 112.249 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -69.28 -46.41 67.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.527 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -82.79 172.91 12.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.147 -0.478 . . . . 10.0 109.839 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.0 mt 73.45 -46.56 0.64 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.164 0.586 . . . . 10.0 111.047 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 110.9 63.48 0.5 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 121.185 -0.531 . . . . 10.0 112.68 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 43.5 mtt -101.68 128.45 47.99 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.844 0.354 . . . . 10.0 110.711 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 2.8 mm-40 -132.56 -174.39 3.44 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.63 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.418 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 42.5 tp10 -66.28 138.33 57.57 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.183 -179.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 66.27 26.3 10.39 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 123.727 0.642 . . . . 10.0 111.9 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.4 OUTLIER -76.3 141.52 41.59 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.851 -0.426 . . . . 10.0 109.851 179.04 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 59.6 t -96.36 120.26 45.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.504 -178.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 15.3 tt -128.8 138.16 55.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.646 -0.707 . . . . 10.0 109.193 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -112.74 149.7 32.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.97 0.414 . . . . 10.0 111.462 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.4 p -130.96 133.86 62.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.184 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -124.84 168.77 12.79 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.985 -0.552 . . . . 10.0 109.577 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -83.08 138.76 33.57 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.362 -0.607 . . . . 10.0 109.362 178.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.433 ' OE2' ' HD3' ' A' ' 63' ' ' ARG . 2.8 mm-40 -74.67 170.41 15.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.197 0.522 . . . . 10.0 111.139 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -82.87 -28.87 29.75 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.483 -0.78 . . . . 10.0 109.687 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -74.35 -55.15 6.33 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.603 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 104.4 11.87 30.26 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.608 -0.806 . . . . 10.0 112.835 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.794 0 CA-C-O 118.891 -0.949 . . . . 10.0 111.913 179.548 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 121.22 0.534 . . . . 10.0 110.869 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 63.0 t-20 -121.16 124.09 43.88 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.458 -0.571 . . . . 10.0 109.458 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 33.2 ptt180 -123.3 126.08 46.24 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.286 0.565 . . . . 10.0 112.507 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -125.33 128.68 24.68 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 108.263 -1.014 . . . . 10.0 108.263 176.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -111.02 128.0 0.03 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 121.851 1.7 . . . . 10.0 113.52 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 6.1 mt -120.51 137.26 54.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 114.807 -1.088 . . . . 10.0 109.965 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 37.7 t -112.54 134.57 54.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.309 -0.626 . . . . 10.0 109.309 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 364' ' ' ILE . . . . . 0.574 HD11 ' HG3' ' A' ' 46' ' ' LYS . 7.6 tp . . . . . 0 C--N 1.318 -0.777 0 CA-C-N 114.809 -1.087 . . . . 10.0 111.514 -176.113 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 N--CA 1.475 0.822 0 CA-C-O 120.782 0.325 . . . . 10.0 110.436 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 18.1 mm -106.3 123.18 60.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.499 -0.556 . . . . 10.0 109.499 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.478 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 4.5 ttpm? -96.47 108.12 20.63 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.183 0.516 . . . . 10.0 110.691 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.8 mt -93.36 137.37 32.73 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.844 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -99.87 106.97 18.86 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.116 0.484 . . . . 10.0 110.819 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.0 t -89.41 130.15 39.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.293 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 41.7 mm -91.01 111.59 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.905 0.383 . . . . 10.0 110.779 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -77.37 157.86 46.8 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.689 -0.687 . . . . 10.0 112.235 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 12.6 tp60 -58.52 -32.24 68.65 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -97.07 29.16 3.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.775 0.321 . . . . 10.0 111.387 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 m 64.52 35.4 9.38 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.351 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.23 136.98 32.72 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.725 -0.67 . . . . 10.0 110.101 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -100.16 101.04 11.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.891 0.376 . . . . 10.0 110.344 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -88.61 120.61 37.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.268 -0.423 . . . . 10.0 109.94 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -100.18 98.62 9.3 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -99.98 118.63 36.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.143 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.4 ttmt -91.9 103.49 16.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.241 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 5.0 m -100.2 171.36 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.24 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -121.53 141.73 50.77 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.225 -0.443 . . . . 10.0 109.976 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.411 ' O ' ' HB ' ' A' ' 41' ' ' THR . 57.8 tpp -81.08 73.05 8.13 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.016 0.436 . . . . 10.0 111.032 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.411 ' HB ' ' O ' ' A' ' 40' ' ' MET . 8.9 t 175.95 -26.16 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.192 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.57 147.36 25.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.254 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 29.8 m80 -75.52 148.8 38.67 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.242 -0.281 . . . . 10.0 110.242 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.514 ' HA ' HD23 ' A' ' 47' ' ' LEU . 35.7 mt -67.66 -10.53 53.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.813 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.552 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 51.2 tptt -57.77 -43.85 85.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.766 -0.652 . . . . 10.0 109.738 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -67.4 -32.21 72.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.395 -0.821 . . . . 10.0 110.956 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.514 HD23 ' HA ' ' A' ' 44' ' ' LEU . 2.7 mm? -74.05 -42.92 59.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.542 -178.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -59.76 -48.37 81.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.939 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 20.0 pt-20 -67.7 -37.81 82.77 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.864 0.32 . . . . 10.0 111.864 -178.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.6 m -68.34 -32.6 72.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.695 0.283 . . . . 10.0 111.463 -179.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 50.1 t80 -66.87 -39.05 87.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.893 0.377 . . . . 10.0 110.224 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.528 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 81.2 m -62.17 -36.72 82.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.41 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -65.14 -35.96 82.76 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.121 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -64.8 -36.16 83.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.69 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -92.24 -6.92 49.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.394 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 69.58 36.81 77.08 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.917 -0.658 . . . . 10.0 112.43 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.512 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 17.6 m -126.0 155.21 73.59 Favored Pre-proline 0 C--N 1.323 -0.583 0 N-CA-C 110.133 -0.321 . . . . 10.0 110.133 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -68.85 157.85 60.2 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.126 1.884 . . . . 10.0 111.588 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.528 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 9.4 ttt -69.72 154.74 41.56 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.036 -0.265 . . . . 10.0 110.344 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.3 t30 77.35 -3.59 2.43 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 123.939 0.775 . . . . 10.0 111.575 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 87.5 p -83.84 -19.0 35.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.204 0.526 . . . . 10.0 109.71 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 82.6 mt -117.02 126.13 52.41 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.268 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.465 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.8 ptt-85 -100.0 121.86 42.02 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.095 0.474 . . . . 10.0 109.858 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -89.99 111.9 23.13 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.8 mt -99.61 113.3 25.64 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.227 -178.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -113.82 101.61 9.45 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.375 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 60.57 38.37 18.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.026 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.07 -34.0 4.79 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.852 -0.613 . . . . 10.0 113.045 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -83.7 135.04 34.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.716 0.294 . . . . 10.0 110.819 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -83.46 131.81 35.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.979 0.419 . . . . 10.0 110.416 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 48.3 mm -68.27 120.64 16.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.824 -0.625 . . . . 10.0 111.583 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.14 177.67 8.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.278 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.552 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 0.8 OUTLIER -83.86 -14.02 52.22 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.552 -0.294 . . . . 10.0 111.504 -179.074 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.4 p-10 -108.89 9.88 26.57 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.679 -0.237 . . . . 10.0 111.391 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.4 ' HB3' HD12 ' A' ' 44' ' ' LEU . 3.1 m170 -78.56 157.36 28.81 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.957 0.408 . . . . 10.0 111.265 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.541 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.8 OUTLIER -136.54 154.0 76.46 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.64 179.521 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -66.42 -11.0 29.71 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.741 2.294 . . . . 10.0 112.745 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -74.62 -24.34 58.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.32 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.541 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.5 pt-20 -107.18 -179.01 3.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.123 -0.49 . . . . 10.0 109.713 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.44 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 6.1 mt 71.21 -62.76 0.44 Allowed 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.762 0.664 . . . . 10.0 111.113 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 130.59 59.89 0.1 OUTLIER Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 111.654 -0.578 . . . . 10.0 111.654 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 53.6 mtt -97.38 125.93 42.31 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.75 0.31 . . . . 10.0 110.827 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.441 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.6 mm-40 -127.64 -175.39 3.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.878 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.478 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 15.3 tp10 -71.38 138.11 48.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.445 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 64.64 34.34 9.87 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 123.565 0.54 . . . . 10.0 110.723 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.0 OUTLIER -79.53 147.69 32.07 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.24 179.683 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.4 t -103.17 124.64 57.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.987 0.423 . . . . 10.0 111.585 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.4 tt -131.95 147.15 32.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.985 -0.552 . . . . 10.0 109.723 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -107.41 151.55 25.38 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.871 0.367 . . . . 10.0 111.381 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.8 p -135.83 125.83 41.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.887 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -133.18 160.59 36.79 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.73 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.78 133.79 35.14 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.398 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.465 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.9 mm-40 -76.47 150.61 36.65 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.724 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -68.14 -21.68 64.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.939 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.8 p -76.97 -15.05 59.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.949 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.29 5.32 66.42 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 121.105 -0.569 . . . . 10.0 112.296 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.876 0 CA-C-O 118.719 -1.045 . . . . 10.0 111.097 -179.426 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 54.7 t30 . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.655 0.264 . . . . 10.0 111.28 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -122.03 120.03 33.16 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.04 -1.096 . . . . 10.0 108.04 177.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -129.59 129.79 44.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.179 0.514 . . . . 10.0 112.131 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 360' ' ' ASP . . . . . 0.42 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 27.1 t0 -121.59 128.09 25.78 Favored Pre-proline 0 C--N 1.308 -1.218 0 N-CA-C 107.06 -1.459 . . . . 10.0 107.06 175.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 361' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 77.7 Cg_endo -108.86 128.48 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 121.89 1.726 . . . . 10.0 113.695 -178.634 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.3 mt -120.64 134.6 63.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 114.549 -1.205 . . . . 10.0 110.171 179.482 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 6.0 t -115.08 135.61 54.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 109.08 -0.711 . . . . 10.0 109.08 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 364' ' ' ILE . . . . . 0.44 HD12 ' HA ' ' B' ' 364' ' ' ILE . 7.2 tp . . . . . 0 C--N 1.323 -0.544 0 CA-C-N 115.503 -0.771 . . . . 10.0 112.423 -176.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 110.063 -0.347 . . . . 10.0 110.063 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.2 mm -111.49 113.23 43.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.325 -0.398 . . . . 10.0 109.962 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.516 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.9 OUTLIER -96.05 109.48 21.89 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.312 0.577 . . . . 10.0 110.282 179.629 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 67.1 mt -95.67 144.01 26.45 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.039 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.5 mtpt -104.43 109.67 21.63 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.896 0.379 . . . . 10.0 110.548 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.454 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.3 t -90.37 128.9 41.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.93 -0.577 . . . . 10.0 109.517 179.285 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.5 mm -87.98 109.49 19.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.369 -0.378 . . . . 10.0 111.349 -179.408 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.01 160.29 40.55 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.79 -0.719 . . . . 10.0 111.365 178.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -62.72 -35.84 81.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.89 0.345 . . . . 10.0 111.47 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 17.0 p-10 -88.88 27.94 1.25 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.935 0.397 . . . . 10.0 111.235 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.9 m 61.38 30.54 19.03 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.575 -0.739 . . . . 10.0 111.442 179.318 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.3 p -82.49 133.31 35.2 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.524 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.527 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 37.0 mt-10 -95.82 96.34 8.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.175 0.512 . . . . 10.0 110.231 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.454 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 2.1 mm -85.68 115.91 27.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.294 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.3 m170 -95.69 96.99 9.37 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.796 -0.446 . . . . 10.0 109.796 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.47 114.46 26.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.641 -179.396 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -91.25 105.87 18.1 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.195 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.9 m -111.41 170.5 3.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.684 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -117.21 149.31 40.62 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.877 -0.416 . . . . 10.0 109.877 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 60.4 tpp -78.27 69.64 4.51 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.557 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 173.87 -29.85 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.587 179.189 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.8 137.64 52.01 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.0 m80 -70.84 138.51 50.34 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.093 -0.503 . . . . 10.0 109.889 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.9 mt -66.8 -7.63 22.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.495 -0.32 . . . . 10.0 111.758 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -57.94 -49.63 76.11 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.6 ttpt -70.3 -34.24 72.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.44 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.429 ' HA ' HD13 ' A' ' 47' ' ' LEU . 2.3 mm? -65.17 -44.65 87.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.86 0.362 . . . . 10.0 110.836 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -60.26 -44.63 95.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.967 -0.56 . . . . 10.0 111.66 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.484 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 17.9 pt-20 -74.53 -34.99 63.13 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.697 -0.401 . . . . 10.0 111.221 -179.403 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.52 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 67.6 m -60.25 -37.36 80.17 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-O 121.072 0.463 . . . . 10.0 110.347 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -64.3 -40.83 96.72 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.562 -0.533 . . . . 10.0 109.562 178.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.414 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 56.7 m -63.93 -39.23 93.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.477 -0.783 . . . . 10.0 110.079 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.52 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 60.4 mt-30 -66.06 -36.06 82.2 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.046 179.319 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -67.64 -37.77 82.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.672 -0.694 . . . . 10.0 110.774 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -80.79 -29.5 36.09 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.999 0.428 . . . . 10.0 110.797 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 96.26 31.06 7.41 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.831 -0.7 . . . . 10.0 112.242 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.414 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 10.9 m -129.8 155.62 80.18 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 110.182 -0.303 . . . . 10.0 110.182 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -67.25 157.74 60.31 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.375 2.05 . . . . 10.0 111.511 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.403 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 10.6 ttt -67.0 156.4 36.1 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.892 -0.323 . . . . 10.0 111.116 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.3 t30 79.06 -8.5 1.63 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.876 0.87 . . . . 10.0 111.953 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 82.8 p -75.75 -23.7 56.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.244 0.545 . . . . 10.0 109.949 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 50.2 mt -116.0 141.33 48.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.482 -0.781 . . . . 10.0 109.981 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' A' ' 63' ' ' ARG . 12.7 ptt180 -113.13 129.19 56.59 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.988 0.423 . . . . 10.0 110.11 179.153 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -95.99 124.79 40.14 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.825 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.1 mt -115.29 126.16 54.15 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.159 0.505 . . . . 10.0 110.926 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -124.88 100.35 6.56 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.246 -0.888 . . . . 10.0 109.058 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 64.98 33.82 9.43 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.066 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.24 -14.42 62.38 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 115.725 -0.671 . . . . 10.0 113.24 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -97.02 136.0 38.21 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.833 -0.432 . . . . 10.0 109.833 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -83.86 140.03 32.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.096 0.474 . . . . 10.0 110.66 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 50.0 mm -77.35 118.3 23.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.728 -0.669 . . . . 10.0 111.083 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.57 160.32 21.45 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.51 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -64.84 -25.84 68.08 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.378 -0.374 . . . . 10.0 111.5 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -95.59 7.12 47.18 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.431 -0.35 . . . . 10.0 111.659 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 3.6 m170 -78.3 150.26 33.35 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.221 0.534 . . . . 10.0 111.412 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.59 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -132.34 148.66 70.59 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.578 -0.737 . . . . 10.0 110.101 179.254 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -60.38 -17.23 46.16 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.695 2.263 . . . . 10.0 112.569 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -67.01 -33.89 76.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.778 -0.647 . . . . 10.0 110.474 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.59 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.4 pt-20 -96.8 173.77 7.14 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.316 -0.402 . . . . 10.0 109.918 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.433 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 87.6 mt 72.34 -59.15 0.57 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.456 0.703 . . . . 10.0 110.512 -178.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 120.78 87.07 0.95 Allowed Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 121.211 -0.518 . . . . 10.0 111.96 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 62.4 mtt -117.61 132.73 56.46 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.611 0.243 . . . . 10.0 110.415 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -126.67 179.2 5.46 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.817 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.516 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 17.2 tp10 -69.89 137.18 51.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.071 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.468 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 5.4 mm-40 71.93 20.38 4.45 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 123.748 0.655 . . . . 10.0 111.591 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.13 147.17 38.73 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.887 -0.325 . . . . 10.0 110.278 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.9 t -99.02 133.71 40.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.88 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.7 tt -134.99 144.13 35.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 178.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -105.92 155.19 19.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.135 0.493 . . . . 10.0 111.997 -178.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.9 p -139.87 127.19 24.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.458 -0.792 . . . . 10.0 109.326 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -133.64 157.89 44.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.606 -0.27 . . . . 10.0 110.391 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -74.6 133.75 42.16 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.14 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.497 ' OE1' ' HA ' ' A' ' 93' ' ' GLU . 3.9 mm-40 -75.69 155.08 36.05 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.754 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -71.78 -24.99 61.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.46 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.2 p -66.92 -39.25 87.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.149 0.499 . . . . 10.0 110.498 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.44 0.9 75.58 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.768 -0.73 . . . . 10.0 112.195 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.825 -0.986 . . . . 10.0 111.295 -179.983 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 121.2 0.524 . . . . 10.0 110.864 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 358' ' ' ASN . . . . . 0.527 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 52.3 t30 -116.74 124.39 49.51 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 108.904 -0.776 . . . . 10.0 108.904 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 359' ' ' ARG . . . . . 0.405 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 16.5 ptt180 -124.69 128.26 48.55 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.45 0.643 . . . . 10.0 111.277 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -120.51 130.37 24.88 Favored Pre-proline 0 C--N 1.314 -0.936 0 N-CA-C 106.631 -1.618 . . . . 10.0 106.631 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -108.23 129.26 0.05 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.331 0 C-N-CA 121.728 1.618 . . . . 10.0 113.317 -178.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.8 mt -116.39 131.8 67.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.379 -1.282 . . . . 10.0 109.352 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 25.9 t -114.96 131.55 66.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.675 0.75 . . . . 10.0 109.43 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 364' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' B' ' 364' ' ' ILE . 7.0 tp . . . . . 0 C--N 1.313 -0.995 0 CA-C-N 114.126 -1.397 . . . . 10.0 110.683 -177.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 . . . . . 0 N--CA 1.478 0.933 0 N-CA-C 110.111 -0.329 . . . . 10.0 110.111 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.8 mm -96.08 113.78 31.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 109.78 -0.452 . . . . 10.0 109.78 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -98.2 115.22 27.89 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.737 0.303 . . . . 10.0 110.497 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 31.1 mt -100.92 145.51 28.55 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.526 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.437 ' HG2' ' CD2' ' A' ' 35' ' ' HIS . 42.0 mtpt -106.58 102.77 12.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.475 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.41 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.9 t -87.37 130.67 36.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 109.541 -0.54 . . . . 10.0 109.541 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.8 mm -102.41 114.61 42.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.893 0.378 . . . . 10.0 110.438 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.17 175.38 54.65 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.801 -0.636 . . . . 10.0 112.705 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.7 tp60 -61.42 -29.5 69.98 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 122.57 0.348 . . . . 10.0 111.66 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -97.64 18.97 14.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.817 0.342 . . . . 10.0 110.581 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.3 m 70.37 24.36 4.71 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.469 -0.787 . . . . 10.0 111.893 179.358 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 p -72.25 137.38 46.76 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.835 -0.432 . . . . 10.0 109.835 179.193 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.473 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 16.7 mt-10 -100.4 107.08 18.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.182 0.515 . . . . 10.0 110.296 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.41 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 3.6 mm -97.38 118.93 44.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.384 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.437 ' CD2' ' HG2' ' A' ' 25' ' ' LYS . 41.9 m80 -96.35 96.21 8.59 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.994 0.426 . . . . 10.0 110.061 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.4 116.18 28.44 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.311 -0.404 . . . . 10.0 109.939 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -87.32 103.37 15.41 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.09 -0.505 . . . . 10.0 109.859 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.464 HG12 HD11 ' A' ' 47' ' ' LEU . 2.6 m -108.76 169.88 3.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.043 0.449 . . . . 10.0 111.743 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -117.79 143.41 46.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.096 -0.502 . . . . 10.0 109.836 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 54.3 tpp -78.23 65.26 3.54 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.372 0.606 . . . . 10.0 110.199 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 78.6 m -164.04 -46.81 0.03 OUTLIER 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.617 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.29 147.17 52.56 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.427 -0.806 . . . . 10.0 111.611 -179.319 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 43.6 m80 -75.31 151.89 38.24 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.659 -0.496 . . . . 10.0 109.659 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.7 mt -70.95 -10.74 60.23 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.455 -0.339 . . . . 10.0 111.492 -179.154 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.59 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 41.8 tttp -63.06 -47.91 80.95 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.978 -0.379 . . . . 10.0 109.978 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -56.28 -40.61 74.54 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.948 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.464 HD11 HG12 ' A' ' 38' ' ' VAL . 3.6 mm? -64.03 -40.67 96.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.781 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -66.75 -47.25 72.84 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.923 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -69.81 -36.11 75.36 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.045 0.387 . . . . 10.0 112.045 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 49.4 m -75.59 -29.98 59.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.628 0.251 . . . . 10.0 111.397 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -65.14 -36.38 84.08 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.966 0.412 . . . . 10.0 110.512 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 63.2 m -60.02 -31.69 70.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.673 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -69.96 -31.25 68.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.901 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -67.76 -37.19 81.78 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.679 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -89.27 -14.32 36.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.352 -0.386 . . . . 10.0 111.269 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.94 36.14 29.16 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.896 -0.669 . . . . 10.0 112.392 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.1 m -123.71 159.78 54.21 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 110.561 -0.163 . . . . 10.0 110.561 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -68.27 167.22 22.73 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.221 1.947 . . . . 10.0 111.733 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.46 140.23 57.08 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.209 -179.365 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.8 t30 69.83 22.17 6.08 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.251 -0.886 . . . . 10.0 112.632 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.9 p -87.82 -23.17 24.11 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.44 0.638 . . . . 10.0 109.358 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 37.2 mt -117.69 134.98 54.33 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.372 -0.831 . . . . 10.0 109.786 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.429 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.2 ptt-85 -104.03 127.27 51.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.121 0.486 . . . . 10.0 110.393 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.458 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 87.4 m-85 -90.13 123.71 34.2 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.475 -0.784 . . . . 10.0 109.983 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.3 mt -110.51 118.35 36.01 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.106 0.479 . . . . 10.0 111.019 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -125.61 116.28 21.47 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.353 -0.84 . . . . 10.0 108.793 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 64.9 25.3 12.78 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.125 0.488 . . . . 10.0 110.737 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.19 -9.63 76.18 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.722 -0.672 . . . . 10.0 112.909 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -107.14 145.27 32.73 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 122.649 -0.324 . . . . 10.0 110.389 -179.4 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.458 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 14.2 ptm180 -82.5 137.03 34.74 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.234 0.54 . . . . 10.0 110.706 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.2 mm -71.64 119.92 18.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.848 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -74.32 164.22 26.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.427 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.59 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 0.1 OUTLIER -78.34 -1.8 35.04 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.985 0.421 . . . . 10.0 111.501 -179.016 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -121.87 16.1 10.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.254 0.55 . . . . 10.0 110.301 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -84.13 148.11 26.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.238 -179.557 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.555 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.3 OUTLIER -119.24 145.31 38.12 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.516 -0.765 . . . . 10.0 109.465 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 77' ' ' PRO . . . . . 0.462 ' HD2' HG22 ' A' ' 76' ' ' THR . 31.2 Cg_exo -60.42 -16.07 39.58 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.415 2.076 . . . . 10.0 112.574 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -69.35 -42.86 74.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.741 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 76' ' ' THR . 8.8 pt-20 -84.25 177.26 8.26 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.432 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 11.0 mt 72.94 -54.62 0.69 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.1 0.56 . . . . 10.0 110.773 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 119.2 64.13 0.28 Allowed Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.976 -0.63 . . . . 10.0 112.652 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 47.9 mtt -97.79 135.04 40.13 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.828 0.347 . . . . 10.0 110.586 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 4.9 mm-40 -133.19 -176.29 4.08 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.2 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 38.8 tp10 -71.09 139.71 50.44 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.663 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 65.65 25.42 11.58 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.209 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -72.27 156.74 38.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.44 -0.345 . . . . 10.0 110.242 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.5 t -111.45 130.94 64.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.894 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.445 HD11 ' HB3' ' A' ' 64' ' ' PHE . 18.0 tt -137.15 142.31 37.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -102.35 150.69 23.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.89 0.376 . . . . 10.0 111.451 -178.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -131.61 124.61 54.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.877 -0.602 . . . . 10.0 109.533 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -127.36 158.16 38.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.425 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -87.63 130.92 34.61 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.865 0.364 . . . . 10.0 111.636 -178.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.429 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 6.4 mm-40 -71.9 143.5 49.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.879 -0.601 . . . . 10.0 109.97 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -68.32 -25.69 65.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.059 -0.519 . . . . 10.0 111.493 -179.071 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 32.5 p -71.88 -28.47 63.54 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.937 0.398 . . . . 10.0 110.967 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 80.61 10.4 85.27 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.937 -0.649 . . . . 10.0 111.98 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.949 0 CA-C-O 118.84 -0.978 . . . . 10.0 111.322 -179.862 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 55.7 t30 . . . . . 0 N--CA 1.483 1.186 0 CA-C-O 121.134 0.493 . . . . 10.0 110.26 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 358' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 50.1 t30 -120.69 123.76 43.52 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.557 -0.905 . . . . 10.0 108.557 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -125.91 127.08 45.44 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 360' ' ' ASP . . . . . 0.427 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 20.6 t0 -122.71 128.7 25.3 Favored Pre-proline 0 C--N 1.318 -0.776 0 N-CA-C 107.394 -1.336 . . . . 10.0 107.394 176.149 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 361' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 57.9 Cg_endo -111.14 128.79 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.184 0 C-N-CA 121.728 1.619 . . . . 10.0 113.638 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.2 mt -119.67 136.93 55.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 113.702 -1.59 . . . . 10.0 109.732 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -113.07 135.77 51.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.394 0.616 . . . . 10.0 109.643 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 5.2 tp . . . . . 0 C--N 1.324 -0.53 0 CA-C-N 115.272 -0.876 . . . . 10.0 111.765 -176.366 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 110.126 -0.324 . . . . 10.0 110.126 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.422 ' HB ' HG22 ' A' ' 38' ' ' VAL . 31.6 mm -102.79 108.98 25.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.431 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -93.87 96.3 9.65 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.207 0.527 . . . . 10.0 110.61 -179.301 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 45.0 mt -82.23 149.83 27.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.614 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -105.82 107.89 19.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.24 -0.437 . . . . 10.0 110.201 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.497 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.8 t -89.3 121.83 39.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.371 -0.603 . . . . 10.0 109.371 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.0 mm -86.83 110.85 20.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.904 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.82 159.77 44.26 Favored Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 120.871 -0.68 . . . . 10.0 111.553 179.21 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -62.68 -32.23 73.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.737 0.269 . . . . 10.0 111.525 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -91.75 27.65 2.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.883 0.373 . . . . 10.0 111.342 -179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.9 m 62.56 37.95 12.76 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.777 -0.647 . . . . 10.0 111.179 179.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.85 143.53 26.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.855 -0.611 . . . . 10.0 109.916 179.183 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.455 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 20.9 mt-10 -109.14 97.43 7.04 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.114 0.483 . . . . 10.0 110.654 -179.492 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.497 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 3.0 mm -87.28 127.06 40.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.907 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -103.22 102.6 12.59 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.021 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.19 116.39 30.31 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.7 ttmt -87.44 95.13 9.9 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.76 -0.655 . . . . 10.0 109.611 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.429 HG12 HD11 ' A' ' 47' ' ' LEU . 3.1 m -101.06 163.95 2.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.461 . . . . 10.0 111.516 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -113.83 142.4 46.14 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.869 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.405 ' O ' ' HB ' ' A' ' 41' ' ' THR . 54.3 tpp -80.42 76.8 7.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.999 0.428 . . . . 10.0 111.663 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.405 ' HB ' ' O ' ' A' ' 40' ' ' MET . 8.3 t 173.68 -35.54 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.883 178.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.21 132.65 42.37 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.14 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.7 m80 -64.69 155.95 31.85 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.034 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.402 HD12 ' HB3' ' A' ' 75' ' ' HIS . 48.3 mt -74.51 -0.9 19.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.737 0.303 . . . . 10.0 110.687 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.537 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 12.2 tptp -59.62 -57.33 13.42 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.148 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.403 ' HG3' HD11 ' B' ' 364' ' ' ILE . 4.7 tppp? -59.15 -35.39 73.42 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.482 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.429 HD11 HG12 ' A' ' 38' ' ' VAL . 4.3 mm? -64.67 -48.16 75.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.044 -0.525 . . . . 10.0 111.679 -179.193 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -58.39 -48.46 80.58 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.951 0.352 . . . . 10.0 111.951 -179.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 4.6 pt-20 -70.58 -31.37 68.35 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.015 0.376 . . . . 10.0 112.015 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.0 m -71.95 -36.91 70.01 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.942 -0.303 . . . . 10.0 110.974 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -64.98 -39.34 93.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.852 0.358 . . . . 10.0 110.092 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.419 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 58.6 m -62.1 -36.08 80.64 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 178.813 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -66.85 -39.12 87.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.348 179.157 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -63.38 -41.23 98.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.616 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -78.2 -16.42 57.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.817 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.03 31.83 41.81 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.888 -0.672 . . . . 10.0 112.431 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.7 m -128.34 158.06 72.61 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 110.648 -0.13 . . . . 10.0 110.648 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -64.98 161.62 36.02 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.37 2.046 . . . . 10.0 111.311 178.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.419 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 21.6 ttt -72.22 152.25 42.34 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.038 -0.265 . . . . 10.0 111.124 -179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 11.7 t30 79.13 -3.57 2.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.024 0.93 . . . . 10.0 111.924 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 81.1 p -78.28 -18.23 55.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.255 0.55 . . . . 10.0 109.795 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 56.9 mt -120.84 135.35 55.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.16 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.501 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 10.7 ptt180 -105.38 125.28 50.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.045 0.45 . . . . 10.0 110.323 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -88.28 117.59 27.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.885 179.402 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.3 mt -107.52 123.6 48.67 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.123 0.487 . . . . 10.0 110.346 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -127.27 98.61 5.34 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.582 -0.735 . . . . 10.0 109.839 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 62.29 49.13 4.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.279 -0.873 . . . . 10.0 111.351 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.02 -50.87 2.51 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.962 -0.637 . . . . 10.0 113.49 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -80.38 163.19 24.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.868 0.366 . . . . 10.0 111.34 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -101.91 152.4 20.96 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.375 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 46.2 mm -82.33 121.26 35.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.96 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -79.56 163.78 24.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.994 -0.548 . . . . 10.0 109.883 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.67 -21.0 61.14 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.837 0.351 . . . . 10.0 111.706 -179.204 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -100.83 5.37 43.43 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.697 -0.228 . . . . 10.0 111.235 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.402 ' HB3' HD12 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -74.65 149.03 40.15 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.599 -179.645 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 23.9 p -123.23 157.42 61.22 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.109 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -69.0 -8.06 22.55 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.514 2.143 . . . . 10.0 112.253 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -79.25 -35.97 40.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.773 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.473 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 7.8 pt-20 -92.21 173.03 8.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.037 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.473 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 52.2 mt 73.78 -42.39 0.51 Allowed 'General case' 0 N--CA 1.469 0.519 0 O-C-N 123.692 0.62 . . . . 10.0 110.947 -179.204 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 105.41 84.95 1.79 Allowed Glycine 0 N--CA 1.444 -0.824 0 C-N-CA 121.174 -0.536 . . . . 10.0 112.362 179.55 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 52.5 mtt -114.88 148.26 38.84 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.847 -0.427 . . . . 10.0 109.847 179.658 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.9 mm-40 -146.12 174.67 11.1 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.954 0.406 . . . . 10.0 110.971 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.431 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 20.7 tp10 -65.9 135.5 54.86 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.896 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 18.5 mm-40 69.26 25.65 5.58 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 123.574 0.546 . . . . 10.0 111.558 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.3 t0 -71.92 167.2 20.57 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.824 -0.351 . . . . 10.0 110.091 179.361 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.0 t -113.9 117.57 55.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 120.912 0.387 . . . . 10.0 111.836 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 16.9 tt -125.72 139.54 51.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.812 -0.631 . . . . 10.0 109.32 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -113.25 146.63 39.03 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.865 0.364 . . . . 10.0 111.1 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.2 p -133.92 130.76 55.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.145 -0.48 . . . . 10.0 109.811 179.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -134.49 166.6 22.5 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.34 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -76.29 141.47 41.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.685 0.278 . . . . 10.0 110.813 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.501 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 1.1 mm-40 -86.41 151.27 23.68 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.368 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -72.61 -22.08 61.01 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.231 0.539 . . . . 10.0 110.262 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -30.79 69.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.585 -0.734 . . . . 10.0 110.843 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 88.08 -9.99 72.58 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.892 -0.67 . . . . 10.0 113.051 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.837 0 CA-C-O 118.492 -1.171 . . . . 10.0 111.633 -179.807 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 121.075 0.464 . . . . 10.0 110.599 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -119.7 122.51 41.64 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.607 -0.437 . . . . 10.0 109.88 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 359' ' ' ARG . . . . . 0.455 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 14.7 ptt180 -124.94 128.59 48.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.247 0.546 . . . . 10.0 112.309 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 360' ' ' ASP . . . . . 0.425 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 32.4 t0 -123.41 128.57 25.19 Favored Pre-proline 0 C--N 1.32 -0.708 0 N-CA-C 107.601 -1.259 . . . . 10.0 107.601 177.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 361' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 67.3 Cg_endo -107.91 127.61 0.05 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 121.545 1.497 . . . . 10.0 112.868 -179.074 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 3.0 mt -117.9 136.96 53.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 114.364 -1.289 . . . . 10.0 110.186 -178.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 40.7 t -112.54 135.57 51.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.477 0.656 . . . . 10.0 110.312 -178.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 364' ' ' ILE . . . . . 0.403 HD11 ' HG3' ' A' ' 46' ' ' LYS . 7.9 tp . . . . . 0 C--N 1.321 -0.633 0 CA-C-N 114.444 -1.253 . . . . 10.0 110.729 -177.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.688 0.28 . . . . 10.0 110.357 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.1 mm -100.95 116.84 45.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.634 ' HE2' ' ND1' ' A' ' 35' ' ' HIS . 0.4 OUTLIER -100.43 105.56 17.05 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.119 0.485 . . . . 10.0 110.763 -179.481 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.8 mt -88.57 150.85 22.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.21 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 44.1 mtpt -110.19 119.59 39.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.0 0.429 . . . . 10.0 110.454 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.7 t -102.11 131.35 50.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.712 -0.677 . . . . 10.0 109.44 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.8 mm -101.33 118.31 47.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.899 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.4 155.81 25.36 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.981 -0.628 . . . . 10.0 112.153 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -65.79 -20.73 66.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.008 0.432 . . . . 10.0 111.053 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -89.84 12.59 16.81 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.777 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.9 m 71.22 39.58 0.94 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.533 -0.758 . . . . 10.0 111.578 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 20.7 p -102.84 140.52 37.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.243 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -107.91 99.46 8.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.121 0.486 . . . . 10.0 109.985 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.0 mm -89.04 134.22 29.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.151 -178.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.634 ' ND1' ' HE2' ' A' ' 23' ' ' LYS . 97.5 m-70 -111.44 105.97 14.74 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.603 -0.518 . . . . 10.0 109.603 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -104.02 117.62 34.73 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.875 0.369 . . . . 10.0 110.487 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.9 ttmt -89.58 100.5 13.29 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.119 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 m -103.2 170.18 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.515 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -121.2 142.73 49.62 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 110.079 -0.341 . . . . 10.0 110.079 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.467 ' O ' ' HB ' ' A' ' 41' ' ' THR . 48.7 tpp -74.96 71.39 2.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.442 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.467 ' HB ' ' O ' ' A' ' 40' ' ' MET . 10.1 t 171.86 -29.96 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.278 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.08 139.48 44.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.205 -179.464 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -68.02 137.57 55.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.231 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.477 HD12 ' HB3' ' A' ' 75' ' ' HIS . 63.9 mt -68.08 -9.23 44.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.347 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.0 tptt -58.53 -47.1 85.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.297 0.57 . . . . 10.0 109.471 178.174 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -65.42 -34.46 78.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.236 -0.893 . . . . 10.0 110.539 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.414 HD13 ' HA ' ' A' ' 47' ' ' LEU . 4.3 mm? -68.66 -45.32 72.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.822 -0.626 . . . . 10.0 111.173 -179.288 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -61.56 -45.67 93.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.812 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.433 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 11.1 pt-20 -70.08 -40.27 75.09 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.937 -0.305 . . . . 10.0 111.371 -179.354 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.3 m -61.91 -34.82 76.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.818 0.342 . . . . 10.0 110.772 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -65.79 -40.73 92.24 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.673 -0.492 . . . . 10.0 109.673 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 57.9 m -63.92 -39.78 94.95 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.255 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 49' ' ' GLU . 79.7 mt-30 -65.26 -41.62 94.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.411 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -64.77 -37.45 87.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.938 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.424 ' HB2' HG22 ' A' ' 57' ' ' VAL . 15.0 mm100 -85.75 -3.32 58.87 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.03 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.3 39.65 98.08 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.234 -0.507 . . . . 10.0 112.516 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.424 HG22 ' HB2' ' A' ' 55' ' ' GLN . 4.3 m -124.14 156.2 66.69 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.474 ' HG2' ' HB3' ' A' ' 61' ' ' SER . 11.0 Cg_endo -58.36 165.41 7.48 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.697 2.264 . . . . 10.0 112.431 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 22.4 ttt -69.1 132.28 46.33 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.617 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.0 t30 66.29 25.5 10.49 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.271 -0.877 . . . . 10.0 111.996 179.022 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.474 ' HB3' ' HG2' ' A' ' 58' ' ' PRO . 12.6 p -77.32 -22.32 52.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.564 0.697 . . . . 10.0 109.816 178.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.9 mt -117.92 141.59 48.27 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.082 -0.963 . . . . 10.0 110.372 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.441 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 20.5 ptt-85 -104.87 128.7 53.17 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.751 178.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -94.5 123.97 38.24 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.163 -0.472 . . . . 10.0 110.014 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.7 mt -112.26 121.6 45.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.894 -179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -124.15 113.56 18.5 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.365 -0.834 . . . . 10.0 108.866 178.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.401 ' OE1' ' HA ' ' A' ' 67' ' ' GLU . 4.1 mm-40 63.12 28.75 16.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.253 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 88.0 -4.89 85.47 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 121.088 -0.577 . . . . 10.0 113.126 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -109.33 145.96 35.15 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.948 -0.39 . . . . 10.0 109.948 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -85.86 139.54 31.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.194 0.521 . . . . 10.0 110.795 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.5 mm -74.91 121.5 26.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.881 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -75.29 164.39 26.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.014 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.87 -27.09 60.11 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.698 0.285 . . . . 10.0 111.089 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 -99.99 22.88 10.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.962 0.411 . . . . 10.0 110.562 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.477 ' HB3' HD12 ' A' ' 44' ' ' LEU . 1.5 m170 -85.03 157.05 20.85 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.109 0.481 . . . . 10.0 111.309 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.548 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.2 OUTLIER -134.56 152.3 77.55 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.742 179.108 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -63.11 -13.15 33.67 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.583 2.189 . . . . 10.0 113.013 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.0 tppt? -69.63 -40.98 76.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.441 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.548 ' HG2' ' O ' ' A' ' 76' ' ' THR . 7.6 pt-20 -85.36 169.01 14.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.095 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 22.8 mt 73.78 -60.06 0.54 Allowed 'General case' 0 N--CA 1.468 0.427 0 O-C-N 123.828 0.705 . . . . 10.0 110.599 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 119.79 76.76 0.49 Allowed Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.936 -0.65 . . . . 10.0 112.177 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 65.1 mtt -104.08 118.04 35.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.726 0.298 . . . . 10.0 110.489 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.452 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 17.4 mm-40 -112.51 -177.67 3.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.663 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.49 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 38.6 tp10 -73.85 140.62 45.86 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.224 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 20.3 mm-40 70.49 20.79 5.8 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.638 0.586 . . . . 10.0 111.009 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.6 OUTLIER -71.98 150.24 44.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.077 179.568 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 40.2 t -109.4 122.28 63.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.079 0.466 . . . . 10.0 111.572 -178.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.8 tt -121.65 142.15 39.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -102.58 145.8 29.09 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.711 0.291 . . . . 10.0 111.353 -178.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.4 p -130.46 125.55 59.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.188 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -133.66 156.57 47.67 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.223 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.67 142.24 38.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.79 0.329 . . . . 10.0 111.219 -179.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.441 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.9 mm-40 -81.18 149.62 29.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.411 179.508 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -66.43 -37.15 84.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.106 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 6.4 p -76.38 -12.27 60.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.498 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 84.94 -10.22 63.54 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.835 -0.698 . . . . 10.0 112.092 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.939 0 N-CA-C 110.922 -0.871 . . . . 10.0 110.922 -179.834 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 . . . . . 0 N--CA 1.479 1.023 0 CA-C-O 121.359 0.599 . . . . 10.0 110.35 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -118.5 126.69 52.55 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 108.179 -1.045 . . . . 10.0 108.179 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -124.86 128.07 48.11 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 113.162 0.801 . . . . 10.0 113.162 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -124.0 127.43 25.39 Favored Pre-proline 0 C--N 1.314 -0.943 0 N-CA-C 107.429 -1.323 . . . . 10.0 107.429 175.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -109.81 127.85 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.22 0 C-N-CA 121.779 1.652 . . . . 10.0 113.021 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.5 mt -118.64 136.01 57.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 114.182 -1.372 . . . . 10.0 110.056 -179.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 13.6 t -113.02 137.2 46.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 108.972 -0.751 . . . . 10.0 108.972 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 364' ' ' ILE . . . . . 0.409 ' HA ' HD12 ' B' ' 364' ' ' ILE . 6.4 tp . . . . . 0 C--N 1.316 -0.884 0 CA-C-N 114.867 -1.061 . . . . 10.0 111.696 -176.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.3 mm -105.48 114.01 43.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.379 -0.6 . . . . 10.0 109.379 179.527 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.436 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.7 ttpm? -99.62 103.05 14.73 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.029 0.442 . . . . 10.0 110.506 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 21.8 mt -88.2 153.13 21.48 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.716 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.9 mtpt -107.41 111.15 23.33 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.297 -0.41 . . . . 10.0 109.982 179.062 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.433 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.6 t -95.41 125.82 48.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.874 -0.603 . . . . 10.0 109.62 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.1 mm -95.83 118.87 43.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 120.966 0.413 . . . . 10.0 110.63 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.76 164.75 36.03 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.815 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -62.27 -27.96 69.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.651 0.263 . . . . 10.0 111.378 -179.207 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -91.56 24.4 3.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.451 -0.34 . . . . 10.0 110.808 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.1 m 61.83 38.37 14.77 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.873 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -93.33 145.02 24.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.969 -0.56 . . . . 10.0 109.831 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.501 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 4.3 mt-10 -113.48 98.42 7.07 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.228 0.537 . . . . 10.0 110.337 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.433 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 3.8 mm -87.13 128.13 40.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.723 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.9 m170 -99.13 94.58 6.58 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.633 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.75 113.31 25.35 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.833 0.349 . . . . 10.0 110.21 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -92.68 103.93 16.26 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.418 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 m -104.38 170.15 2.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.871 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -119.0 139.99 50.77 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 56.8 tpp -76.81 62.7 2.08 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.167 0.508 . . . . 10.0 110.379 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 m -163.15 -38.19 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.219 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.85 152.24 28.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.721 -0.672 . . . . 10.0 112.172 -178.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -80.67 152.69 28.32 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.551 -0.749 . . . . 10.0 109.536 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.9 mt -69.66 -6.7 33.24 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.813 0.301 . . . . 10.0 111.813 -179.003 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.418 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 50.0 tptt -60.15 -51.31 70.14 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.827 -0.434 . . . . 10.0 109.827 178.619 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.424 ' HG3' HD11 ' B' ' 364' ' ' ILE . 4.8 tppp? -62.63 -33.51 75.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.539 -0.755 . . . . 10.0 110.651 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.51 -47.13 67.78 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.07 -0.514 . . . . 10.0 111.57 -179.283 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -61.82 -45.19 94.92 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.07 0.396 . . . . 10.0 112.07 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 9.8 pt-20 -68.78 -35.14 76.68 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.75 0.278 . . . . 10.0 111.75 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 64.6 m -68.68 -33.02 73.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.755 0.312 . . . . 10.0 110.712 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.432 ' CG ' ' HZ ' ' A' ' 64' ' ' PHE . 30.5 t80 -68.54 -42.25 78.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.937 0.398 . . . . 10.0 110.185 179.315 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 56.0 m -60.91 -41.82 96.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.954 -0.567 . . . . 10.0 110.216 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -67.08 -30.76 70.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.79 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -69.47 -39.71 77.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.651 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -82.26 -15.75 51.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.216 -179.548 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.07 39.15 10.32 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.653 -0.784 . . . . 10.0 112.387 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.2 m -135.85 153.49 77.19 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 110.08 -0.341 . . . . 10.0 110.08 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -66.29 159.1 51.64 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.232 1.954 . . . . 10.0 111.103 178.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.41 ' SD ' ' HB3' ' A' ' 49' ' ' GLU . 17.2 ttt -68.03 159.53 30.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.714 0.292 . . . . 10.0 111.252 -179.265 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.0 t30 79.7 -16.9 0.62 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.163 0.985 . . . . 10.0 111.743 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 81.0 p -68.49 -37.73 80.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.122 0.487 . . . . 10.0 110.026 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 94.1 mt -102.6 125.33 49.29 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.577 -0.738 . . . . 10.0 110.308 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.504 ' HD3' ' OE2' ' A' ' 93' ' ' GLU . 18.2 ptt180 -106.18 124.78 50.12 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.145 0.498 . . . . 10.0 110.417 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.432 ' HZ ' ' CG ' ' A' ' 51' ' ' TYR . 50.7 m-85 -86.51 126.61 34.56 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.483 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 82.5 mt -113.43 127.7 56.2 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.174 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -135.38 115.72 13.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.464 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 62.3 29.36 17.32 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.529 0.518 . . . . 10.0 110.925 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.32 -37.23 3.48 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.967 -0.635 . . . . 10.0 112.885 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -81.02 158.72 25.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.7 0.286 . . . . 10.0 110.621 -179.389 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.0 ptm180 -96.54 140.66 30.84 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.979 0.419 . . . . 10.0 110.174 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.0 mm -74.15 123.95 30.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.414 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.58 166.9 17.82 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.51 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -81.08 -3.25 51.29 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.933 -178.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.7 p-10 -115.88 4.79 13.93 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.841 0.353 . . . . 10.0 110.624 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 21.5 m170 -78.45 152.57 32.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.398 -179.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.495 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 11.2 p -123.41 153.98 65.75 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.172 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -66.6 -14.28 43.35 Favored 'Trans proline' 0 N--CA 1.472 0.236 0 C-N-CA 122.484 2.123 . . . . 10.0 112.639 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -73.93 -30.65 62.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.538 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 76' ' ' THR . 13.9 pt-20 -98.6 173.49 6.9 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.738 -0.467 . . . . 10.0 109.738 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.432 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 58.4 mt 73.01 -46.96 0.66 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 123.634 0.584 . . . . 10.0 111.235 -179.583 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 112.4 77.03 0.81 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 121.092 -0.575 . . . . 10.0 112.732 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 56.5 mtt -111.67 115.72 29.59 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.748 0.308 . . . . 10.0 110.35 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 25.1 mm-40 -114.35 177.62 4.58 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.069 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.439 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 29.1 tp10 -69.7 139.11 53.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.076 179.397 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 13.1 mm-40 70.57 11.85 7.32 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 123.483 0.49 . . . . 10.0 111.927 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.3 OUTLIER -68.8 147.61 51.51 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.97 -0.292 . . . . 10.0 110.309 179.705 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 92.6 t -98.1 126.39 51.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 121.241 0.543 . . . . 10.0 111.59 -178.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.5 tt -126.39 142.9 41.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.53 -0.759 . . . . 10.0 109.136 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -108.18 157.21 18.51 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.101 0.477 . . . . 10.0 111.841 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.4 p -146.85 125.39 4.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.436 178.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -133.98 169.38 17.2 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.387 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -81.58 134.65 35.52 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.848 0.356 . . . . 10.0 110.965 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.504 ' OE2' ' HD3' ' A' ' 63' ' ' ARG . 2.6 mm-40 -69.42 173.91 5.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.565 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -78.44 -31.35 48.01 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.921 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 16.6 p -72.46 -33.32 66.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.568 -0.742 . . . . 10.0 111.321 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.78 6.32 80.03 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 110.96 -0.856 . . . . 10.0 110.96 -178.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.978 0 N-CA-C 110.716 -0.953 . . . . 10.0 110.716 -179.788 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 66.3 t30 . . . . . 0 N--CA 1.483 1.177 0 CA-C-O 121.283 0.563 . . . . 10.0 110.988 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 358' ' ' ASN . . . . . 0.501 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 5.9 t-20 -120.34 121.09 37.83 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 108.468 -0.938 . . . . 10.0 108.468 178.871 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 359' ' ' ARG . . . . . 0.44 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 16.8 ptt180 -128.66 129.57 46.02 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 113.327 0.862 . . . . 10.0 113.327 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -122.54 130.44 24.66 Favored Pre-proline 0 C--N 1.317 -0.823 0 N-CA-C 107.872 -1.159 . . . . 10.0 107.872 176.449 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -108.36 127.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 121.246 1.297 . . . . 10.0 113.719 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.2 mt -119.26 135.08 60.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 114.407 -1.27 . . . . 10.0 109.93 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 21.0 t -114.49 135.24 54.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 N-CA-C 109.014 -0.735 . . . . 10.0 109.014 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 364' ' ' ILE . . . . . 0.424 HD11 ' HG3' ' A' ' 46' ' ' LYS . 6.5 tp . . . . . 0 C--N 1.315 -0.893 0 CA-C-N 115.082 -0.963 . . . . 10.0 111.502 -176.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 110.382 -0.229 . . . . 10.0 110.382 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.5 mm -110.95 118.87 58.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -100.4 108.71 20.78 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.119 0.485 . . . . 10.0 111.624 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.8 mt -91.46 147.66 22.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.546 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt -105.25 104.58 14.33 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.077 0.465 . . . . 10.0 110.363 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.45 ' O ' HG12 ' A' ' 34' ' ' ILE . 3.6 t -87.77 125.97 41.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.685 -0.689 . . . . 10.0 109.369 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.6 mm -99.44 116.05 41.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 120.888 0.375 . . . . 10.0 110.575 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.84 169.66 42.81 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.719 -0.753 . . . . 10.0 111.93 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -60.02 -33.17 71.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.357 . . . . 10.0 111.486 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -86.69 23.25 1.72 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.572 -179.492 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 72.2 m 61.37 32.21 19.13 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.259 0.552 . . . . 10.0 111.066 179.805 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.03 140.1 31.28 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.73 -0.668 . . . . 10.0 109.714 179.303 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.491 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 12.8 mt-10 -107.62 96.47 6.42 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.106 0.479 . . . . 10.0 110.251 -179.737 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 26' ' ' VAL . 1.2 mm -82.66 127.44 39.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.657 -179.169 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -96.17 87.68 4.6 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.36 106.26 17.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.336 -179.251 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -92.2 104.69 17.03 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.946 0.403 . . . . 10.0 110.701 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 5.1 m -103.45 167.16 2.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.202 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 64.8 tttt -117.31 137.8 52.19 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 110.164 -0.31 . . . . 10.0 110.164 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.438 ' O ' ' HB ' ' A' ' 41' ' ' THR . 57.6 tpp -75.11 76.13 2.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.014 0.435 . . . . 10.0 110.711 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.438 ' HB ' ' O ' ' A' ' 40' ' ' MET . 8.7 t 173.13 -30.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.127 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.67 145.86 28.56 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.406 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -76.43 147.32 38.03 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.189 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.416 HD12 ' HB3' ' A' ' 75' ' ' HIS . 49.2 mt -69.02 -7.33 34.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.951 0.405 . . . . 10.0 110.657 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 28.2 tptt -56.15 -52.58 63.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.24 178.681 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.404 ' HG2' HD11 ' B' ' 364' ' ' ILE . 23.4 ttpt -69.9 -32.83 71.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.685 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.473 ' HA ' HD13 ' A' ' 47' ' ' LEU . 3.3 mm? -63.87 -39.47 94.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.273 -0.421 . . . . 10.0 111.045 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -61.69 -44.27 97.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.67 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -76.03 -28.67 57.81 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 121.017 -0.273 . . . . 10.0 111.368 -179.392 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.411 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 66.4 m -63.24 -38.7 92.18 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.952 0.406 . . . . 10.0 111.008 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -67.07 -35.33 79.59 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.898 -0.408 . . . . 10.0 109.898 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.474 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.9 m -62.19 -40.57 96.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.736 -0.666 . . . . 10.0 109.895 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.411 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.3 mt-30 -64.21 -41.08 97.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.527 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -66.95 -32.41 73.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.176 -0.466 . . . . 10.0 110.678 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -84.84 -11.85 54.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.129 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.93 32.31 63.69 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.994 -0.622 . . . . 10.0 112.266 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.9 m -131.37 154.59 81.96 Favored Pre-proline 0 C--N 1.324 -0.543 0 N-CA-C 110.54 -0.171 . . . . 10.0 110.54 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -64.27 164.29 23.37 Favored 'Trans proline' 0 CA--C 1.53 0.277 0 C-N-CA 122.449 2.099 . . . . 10.0 111.577 178.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.474 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 11.6 ttt -72.61 157.83 36.82 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 121.236 -0.186 . . . . 10.0 110.934 -179.346 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.3 t30 75.12 5.35 4.25 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.525 0.73 . . . . 10.0 111.947 178.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 55.6 p -86.69 -26.36 24.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.371 0.605 . . . . 10.0 109.926 179.295 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 48.7 mt -117.35 143.23 46.18 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.406 -0.815 . . . . 10.0 110.678 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.522 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 14.2 ptt-85 -115.42 127.7 55.54 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.284 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.459 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 25.3 m-85 -90.37 121.72 32.61 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.061 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 55.4 mt -107.94 111.44 23.54 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.128 0.489 . . . . 10.0 110.709 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -121.7 121.84 38.23 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.409 -0.814 . . . . 10.0 109.022 179.557 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 63.2 19.34 11.61 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.434 0.459 . . . . 10.0 110.962 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.62 -21.86 43.88 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.925 -0.655 . . . . 10.0 112.585 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -98.14 161.23 13.82 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.572 0.225 . . . . 10.0 110.636 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.459 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 13.3 ptm180 -95.46 143.45 26.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.017 0.437 . . . . 10.0 110.698 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.3 mm -77.95 127.36 38.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.646 -0.706 . . . . 10.0 111.803 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.94 166.44 13.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.33 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.479 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -73.35 -13.64 61.14 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.659 0.266 . . . . 10.0 111.521 -179.284 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -105.64 10.7 32.84 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.791 0.329 . . . . 10.0 111.229 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.416 ' HB3' HD12 ' A' ' 44' ' ' LEU . 1.6 m170 -83.65 149.03 26.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.102 0.477 . . . . 10.0 111.124 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.421 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -129.42 148.09 67.82 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.692 178.888 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 77' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 76' ' ' THR . 24.3 Cg_exo -64.32 -6.69 12.21 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.718 2.279 . . . . 10.0 112.798 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.9 tppt? -75.15 -27.27 59.65 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.902 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 76' ' ' THR . 3.2 pt-20 -108.69 -174.99 2.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.556 -179.397 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 41.0 mt 72.17 -58.49 0.59 Allowed 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.894 0.746 . . . . 10.0 110.922 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 129.36 61.16 0.1 Allowed Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 111.693 -0.563 . . . . 10.0 111.693 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 39.8 mtt -98.16 126.22 43.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.935 0.398 . . . . 10.0 110.644 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.493 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -129.84 173.27 10.83 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.364 179.893 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -66.17 138.33 57.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.235 -0.439 . . . . 10.0 109.834 179.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 69.63 25.89 5.13 Favored 'General case' 0 C--O 1.233 0.198 0 O-C-N 123.65 0.594 . . . . 10.0 111.546 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.493 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.6 OUTLIER -74.5 146.33 42.81 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 179.19 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 41.6 t -99.48 126.07 52.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.03 0.443 . . . . 10.0 111.186 -179.156 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.7 tt -135.36 143.01 38.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.971 -0.559 . . . . 10.0 109.683 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -110.47 153.62 24.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.018 0.437 . . . . 10.0 110.848 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.9 p -132.42 129.61 59.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.624 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -125.32 165.21 18.77 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.474 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -91.03 132.92 35.71 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.293 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.522 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.9 mm-40 -77.17 152.82 34.66 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.85 0.357 . . . . 10.0 110.807 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -77.64 -14.43 59.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.301 0.572 . . . . 10.0 110.024 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.6 p -71.36 -43.73 66.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.53 -0.759 . . . . 10.0 110.706 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 102.9 -16.21 54.62 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.989 -0.625 . . . . 10.0 112.324 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.933 0 CA-C-O 118.897 -0.946 . . . . 10.0 111.337 -179.617 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 . . . . . 0 N--CA 1.484 1.225 0 CA-C-O 121.044 0.45 . . . . 10.0 110.837 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -120.29 123.13 42.4 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.509 -0.923 . . . . 10.0 108.509 178.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 359' ' ' ARG . . . . . 0.491 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 27.4 ptt180 -126.25 127.86 46.28 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 119.904 -0.718 . . . . 10.0 111.922 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 360' ' ' ASP . . . . . 0.456 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 34.5 t70 -120.87 130.59 24.78 Favored Pre-proline 0 C--N 1.317 -0.819 0 N-CA-C 106.276 -1.749 . . . . 10.0 106.276 177.1 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 361' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 61.2 Cg_endo -108.05 129.22 0.05 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.281 0 C-N-CA 121.589 1.526 . . . . 10.0 114.005 -177.671 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 23.6 mt -119.08 132.09 69.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 CA-C-N 114.32 -1.309 . . . . 10.0 109.971 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 10.5 t -117.28 135.97 55.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 109.495 -0.557 . . . . 10.0 109.495 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 364' ' ' ILE . . . . . 0.421 HD12 ' HA ' ' B' ' 364' ' ' ILE . 5.4 tp . . . . . 0 C--N 1.312 -1.032 0 CA-C-N 114.93 -1.032 . . . . 10.0 110.945 -177.009 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 . . . . . 0 N--CA 1.482 1.167 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.4 mm -107.6 110.12 30.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.89 0.376 . . . . 10.0 110.089 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.423 ' NZ ' ' HB3' ' A' ' 23' ' ' LYS . 1.7 ttpm? -100.05 100.45 11.33 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.159 0.504 . . . . 10.0 110.513 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 33.3 mt -83.27 152.22 25.25 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.101 -179.211 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 40.4 mtpt -110.11 108.85 19.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.06 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.413 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.1 t -90.39 131.07 38.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.274 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.4 mm -89.98 110.83 22.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.464 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -76.14 152.9 42.57 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.846 -0.615 . . . . 10.0 112.172 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -61.88 -22.51 65.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.834 0.349 . . . . 10.0 111.553 -179.478 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -97.29 20.82 10.88 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.841 0.353 . . . . 10.0 110.569 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.2 m 67.42 44.94 1.67 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.605 -0.725 . . . . 10.0 111.128 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.8 p -107.3 149.74 27.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.634 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 10.0 mt-10 -107.5 101.95 11.26 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.41 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 5.6 mm -92.21 125.94 44.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.269 -179.362 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 23.5 m-70 -102.01 101.96 12.41 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.747 -0.464 . . . . 10.0 109.747 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.73 113.98 26.3 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.458 -179.38 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -85.7 99.51 11.36 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.867 -0.42 . . . . 10.0 109.867 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 m -106.13 168.88 2.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.996 -179.357 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.46 ' HE2' ' OG1' ' A' ' 41' ' ' THR . 79.1 tttt -120.0 143.2 48.18 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.855 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 58.9 tpp -76.74 58.56 1.44 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.347 0.594 . . . . 10.0 110.507 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.46 ' OG1' ' HE2' ' A' ' 39' ' ' LYS . 5.7 m -158.07 -42.11 0.06 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.513 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.3 147.94 37.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.837 -0.619 . . . . 10.0 111.251 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.462 ' HA ' HG22 ' A' ' 76' ' ' THR . 7.3 m80 -75.92 151.98 37.2 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.585 ' HA ' HD23 ' A' ' 47' ' ' LEU . 12.6 mt -66.33 -12.45 56.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.753 0.311 . . . . 10.0 111.36 -179.532 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 43.4 tptt -59.12 -44.4 92.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.156 0.503 . . . . 10.0 109.67 178.129 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -64.69 -32.72 74.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.204 -0.907 . . . . 10.0 110.655 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.585 HD23 ' HA ' ' A' ' 44' ' ' LEU . 2.5 mm? -74.96 -41.78 58.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.965 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -60.64 -47.71 85.04 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.898 -179.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -67.31 -46.73 72.65 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.946 0.35 . . . . 10.0 111.946 -178.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.7 m -61.09 -36.38 79.51 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.724 0.268 . . . . 10.0 111.724 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -64.65 -45.84 85.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.774 0.321 . . . . 10.0 110.465 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 60.3 m -59.93 -49.23 78.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.659 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -58.37 -39.88 80.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.128 0.489 . . . . 10.0 110.789 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -64.53 -39.58 94.03 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.154 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -80.3 -6.07 57.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.284 -0.416 . . . . 10.0 111.809 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.91 37.95 17.48 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.654 -0.784 . . . . 10.0 112.694 179.455 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -139.65 150.72 64.22 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 110.028 -0.36 . . . . 10.0 110.028 179.319 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.06 162.15 34.76 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.163 1.909 . . . . 10.0 111.424 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.495 ' HG3' ' N ' ' A' ' 60' ' ' ASN . 0.9 OUTLIER -62.84 147.83 48.91 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.893 -0.14 . . . . 10.0 110.637 179.431 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.495 ' N ' ' HG3' ' A' ' 59' ' ' MET . 35.7 t30 83.62 6.11 0.73 Allowed 'General case' 0 N--CA 1.475 0.823 0 O-C-N 124.069 0.856 . . . . 10.0 112.012 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 57.6 p -90.1 -33.88 16.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.041 0.448 . . . . 10.0 110.294 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 92' ' ' GLN . 33.6 mt -115.2 146.46 41.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.675 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.524 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 15.0 ptt-85 -117.02 135.64 53.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.217 179.131 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -93.98 127.23 39.64 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.169 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.0 mt -109.86 124.15 50.83 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.552 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -138.04 121.69 17.43 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.385 -0.825 . . . . 10.0 109.208 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 61.91 24.97 14.95 Favored 'General case' 0 C--N 1.331 -0.221 0 O-C-N 123.483 0.49 . . . . 10.0 110.989 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.63 2.0 87.2 Favored Glycine 0 CA--C 1.522 0.474 0 C-N-CA 121.115 -0.564 . . . . 10.0 113.07 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -114.19 164.93 13.21 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.945 0.372 . . . . 10.0 110.572 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -100.3 130.26 46.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.015 0.435 . . . . 10.0 110.217 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.9 mm -67.57 124.44 22.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.383 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -85.08 172.76 11.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.304 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 2.6 m-20 -80.88 -15.45 56.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.883 0.373 . . . . 10.0 111.205 -179.273 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -107.49 30.18 6.5 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.219 0.533 . . . . 10.0 110.577 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.412 ' HB3' HD12 ' A' ' 44' ' ' LEU . 2.6 m170 -104.47 152.62 22.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.972 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.462 HG22 ' HA ' ' A' ' 43' ' ' HIS . 6.1 p -130.1 153.81 81.17 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.966 178.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -62.88 -13.78 36.85 Favored 'Trans proline' 0 N--CA 1.475 0.414 0 C-N-CA 122.701 2.267 . . . . 10.0 112.865 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -72.35 -34.36 67.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.839 -179.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 76' ' ' THR . 6.0 pt-20 -94.72 174.34 7.16 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.935 -0.395 . . . . 10.0 109.935 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 15.9 mt 73.84 -41.38 0.48 Allowed 'General case' 0 N--CA 1.468 0.431 0 O-C-N 123.684 0.615 . . . . 10.0 111.249 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 107.79 56.32 0.6 Allowed Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.883 -0.675 . . . . 10.0 112.341 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 47.5 mtt -90.5 128.91 36.68 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.508 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.3 mm-40 -126.56 -179.91 5.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.089 0.471 . . . . 10.0 111.635 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -68.07 140.02 56.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.645 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 62.01 23.61 13.94 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.024 -0.535 . . . . 10.0 111.709 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.508 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.7 t0 -70.75 148.88 47.48 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.204 -0.198 . . . . 10.0 110.548 179.738 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 89.7 t -97.61 114.02 33.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.036 0.446 . . . . 10.0 111.59 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.413 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 18.8 tt -119.61 142.48 34.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -110.83 151.94 27.24 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.029 0.443 . . . . 10.0 111.636 -178.586 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.2 p -136.25 125.54 38.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.64 179.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -131.8 157.24 44.39 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.409 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.422 ' HA ' HD23 ' A' ' 62' ' ' LEU . 6.2 tt0 -75.97 138.89 41.24 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.904 0.383 . . . . 10.0 110.845 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.524 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.2 mm-40 -81.05 147.84 29.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.714 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -70.72 -15.4 62.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.08 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.31 -16.72 58.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.962 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.12 -47.3 3.55 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.963 -0.637 . . . . 10.0 112.352 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.821 0 N-CA-C 110.612 -0.995 . . . . 10.0 110.612 179.993 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 . . . . . 0 N--CA 1.477 0.9 0 CA-C-O 121.244 0.545 . . . . 10.0 109.912 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 358' ' ' ASN . . . . . 0.437 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 53.4 t-20 -121.7 123.86 42.87 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.192 -1.04 . . . . 10.0 108.192 179.065 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -123.12 122.72 39.15 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.414 -0.914 . . . . 10.0 112.811 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 360' ' ' ASP . . . . . 0.417 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 18.5 t70 -128.82 128.39 23.46 Favored Pre-proline 0 C--N 1.319 -0.755 0 N-CA-C 107.398 -1.334 . . . . 10.0 107.398 174.848 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 361' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 54.0 Cg_endo -111.72 128.44 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.141 0 C-N-CA 121.551 1.501 . . . . 10.0 113.789 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.1 mt -117.48 135.61 57.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.06 -0.973 . . . . 10.0 109.311 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 19.6 t -113.99 133.51 59.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.569 0.699 . . . . 10.0 110.626 -178.122 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 4.7 tp . . . . . 0 C--N 1.319 -0.727 0 CA-C-N 114.985 -1.007 . . . . 10.0 111.014 -178.35 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 . . . . . 0 N--CA 1.479 1.019 0 N-CA-C 110.246 -0.279 . . . . 10.0 110.246 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.1 mm -118.52 117.41 54.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.535 ' HZ2' ' CD ' ' A' ' 84' ' ' GLU . 0.0 OUTLIER -97.93 108.75 21.52 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.92 0.391 . . . . 10.0 110.855 -179.816 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 66.7 mt -94.26 126.85 39.76 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.966 -0.561 . . . . 10.0 109.909 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 34' ' ' ILE . 33.4 mtpt -96.84 109.7 22.34 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.01 0.433 . . . . 10.0 110.721 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.4 t -91.98 123.71 44.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.63 -0.713 . . . . 10.0 109.665 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.6 mm -94.06 113.22 28.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 120.984 0.421 . . . . 10.0 110.852 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.6 156.3 33.14 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.81 -0.632 . . . . 10.0 112.087 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -70.15 -12.4 61.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.875 0.369 . . . . 10.0 111.362 -179.229 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -100.69 22.43 11.94 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.35 0.595 . . . . 10.0 110.052 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.2 m 63.71 45.33 4.58 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 114.814 -1.085 . . . . 10.0 111.822 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.2 p -111.58 138.34 48.24 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.206 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.495 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 16.6 mt-10 -108.81 103.94 13.11 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.152 0.501 . . . . 10.0 109.942 179.425 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.475 ' O ' ' HA ' ' A' ' 25' ' ' LYS . 3.9 mm -91.18 129.91 41.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.443 -179.399 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.456 ' CD2' ' HB3' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -109.36 101.28 10.28 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.437 -0.347 . . . . 10.0 110.067 -179.696 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.23 115.35 27.3 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.2 -0.296 . . . . 10.0 110.2 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -88.06 100.13 12.7 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.469 HG12 HD11 ' A' ' 47' ' ' LEU . 3.0 m -107.45 174.04 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.996 0.427 . . . . 10.0 111.544 -178.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.3 tttt -123.23 146.7 47.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.817 -0.629 . . . . 10.0 109.493 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.496 ' O ' ' HB ' ' A' ' 41' ' ' THR . 49.0 tpp -77.64 76.02 4.18 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.089 0.471 . . . . 10.0 111.569 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.496 ' HB ' ' O ' ' A' ' 40' ' ' MET . 15.3 t 170.12 -25.83 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.466 -0.788 . . . . 10.0 110.0 178.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.49 134.01 42.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.239 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 31.5 m170 -70.11 143.78 52.27 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.575 -179.159 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 75.2 mt -69.38 -8.59 47.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 10.0 111.042 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.511 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 37.4 tptt -58.18 -53.99 52.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.527 178.169 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -61.16 -41.74 97.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.525 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.469 HD11 HG12 ' A' ' 38' ' ' VAL . 3.4 mm? -57.97 -41.79 83.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.609 -179.413 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -68.67 -31.98 71.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.403 -0.362 . . . . 10.0 111.315 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.511 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 39.7 mt-10 -75.32 -51.78 12.39 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.751 0.31 . . . . 10.0 111.306 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.0 m -61.33 -33.77 74.16 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.278 0.473 . . . . 10.0 112.278 -179.167 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -63.14 -46.06 89.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.706 0.288 . . . . 10.0 110.778 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.504 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 58.8 m -61.95 -37.23 83.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.093 0.473 . . . . 10.0 110.245 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -61.71 -42.84 99.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.764 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 52.9 ttt85 -69.22 -33.41 73.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.375 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -74.78 -16.42 60.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.708 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.88 30.92 45.66 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.911 -0.661 . . . . 10.0 112.84 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.8 m -137.49 154.53 75.27 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 110.205 -0.295 . . . . 10.0 110.205 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.51 154.64 58.02 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.443 2.095 . . . . 10.0 111.829 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.504 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 3.9 ttt -66.54 157.22 32.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.725 -0.216 . . . . 10.0 110.98 -179.591 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.446 ' N ' ' HG2' ' A' ' 59' ' ' MET . 2.4 t-20 78.02 4.17 2.84 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.633 0.773 . . . . 10.0 111.571 179.036 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.4 p -87.88 -19.98 26.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.076 0.465 . . . . 10.0 109.958 179.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.0 mt -125.77 135.22 51.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.665 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.509 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 29.1 ptt-85 -112.09 138.96 48.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.241 -0.436 . . . . 10.0 109.88 179.202 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -96.19 132.03 42.04 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.9 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.0 mt -115.78 115.69 26.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.005 0.431 . . . . 10.0 111.132 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -128.07 118.57 23.71 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.563 -0.744 . . . . 10.0 109.357 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 61.66 29.97 18.35 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.079 0.466 . . . . 10.0 110.752 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.89 -4.28 75.84 Favored Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.862 -0.608 . . . . 10.0 112.604 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 44.8 mm-40 -102.34 136.79 41.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.576 0.226 . . . . 10.0 110.717 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -82.3 128.71 34.47 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.621 -0.511 . . . . 10.0 109.621 178.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 46.6 mm -70.03 118.84 15.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.229 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -90.11 168.78 11.7 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.295 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.91 -24.83 62.54 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.202 0.525 . . . . 10.0 110.579 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -95.77 24.97 4.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.423 -0.808 . . . . 10.0 111.58 -179.045 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 50.1 m170 -109.32 157.47 18.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.79 0.328 . . . . 10.0 110.837 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.586 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 27.9 p -134.26 160.31 68.97 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.067 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -68.73 -14.22 38.7 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.364 2.042 . . . . 10.0 112.012 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -69.65 -34.11 73.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.882 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.586 ' HG2' ' O ' ' A' ' 76' ' ' THR . 6.3 pt-20 -91.22 168.8 11.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.063 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 17.8 mt 73.01 -48.81 0.69 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.405 0.682 . . . . 10.0 111.432 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.14 58.89 0.33 Allowed Glycine 0 N--CA 1.444 -0.77 0 C-N-CA 120.652 -0.785 . . . . 10.0 112.558 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 43.6 mtt -86.34 120.21 27.44 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 179.196 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -113.17 178.14 4.38 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.204 0.525 . . . . 10.0 111.534 -178.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.535 ' CD ' ' HZ2' ' A' ' 23' ' ' LYS . 3.6 tp10 -69.01 140.52 54.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.413 -0.812 . . . . 10.0 110.762 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 63.6 mm-40 60.59 32.84 20.46 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.792 -0.64 . . . . 10.0 111.582 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -80.61 146.44 31.2 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.663 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 20.2 t -98.11 132.1 43.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.763 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.437 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 20.3 tt -135.42 149.34 28.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.018 179.61 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -108.95 152.49 24.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.982 0.42 . . . . 10.0 111.382 -179.392 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.8 p -135.22 135.86 51.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.469 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -137.37 157.22 47.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.716 -0.22 . . . . 10.0 110.791 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -80.61 131.36 35.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.581 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.509 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.6 mm-40 -69.47 145.28 52.86 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.879 -179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -63.21 -23.13 67.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.07 -0.514 . . . . 10.0 111.441 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.0 p -76.74 -20.39 56.57 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.908 0.385 . . . . 10.0 111.219 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.67 -11.18 62.42 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.005 -0.617 . . . . 10.0 111.948 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.786 -1.008 . . . . 10.0 111.275 -179.808 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 55.9 t30 . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.775 0.322 . . . . 10.0 110.77 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 358' ' ' ASN . . . . . 0.495 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 59.7 t30 -120.24 124.38 45.53 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 109.364 -0.606 . . . . 10.0 109.364 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 24.5 ptt180 -124.2 128.24 48.92 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.42 0.629 . . . . 10.0 111.321 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -120.66 130.33 24.9 Favored Pre-proline 0 C--N 1.318 -0.791 0 N-CA-C 107.569 -1.271 . . . . 10.0 107.569 177.533 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -108.79 130.59 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.232 0 C-N-CA 121.948 1.765 . . . . 10.0 113.456 -178.244 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 2.6 mt -117.67 136.44 54.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 113.967 -1.47 . . . . 10.0 109.705 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 60.3 t -113.42 133.01 60.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 N-CA-C 109.109 -0.7 . . . . 10.0 109.109 -179.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 6.3 tp . . . . . 0 C--N 1.319 -0.752 0 CA-C-N 114.628 -1.169 . . . . 10.0 110.948 -176.963 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 . . . . . 0 N--CA 1.477 0.881 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 11.6 mm -112.79 123.28 68.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.432 -0.581 . . . . 10.0 109.432 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.7 ttpm? -100.18 113.7 26.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.953 0.406 . . . . 10.0 111.207 -179.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 80.3 mt -101.26 140.07 36.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.803 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.0 mtpt -101.77 110.44 22.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.758 0.313 . . . . 10.0 110.766 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.46 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 7.1 t -88.1 123.48 40.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 108.915 -0.772 . . . . 10.0 108.915 178.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.8 mm -92.82 111.95 25.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 120.956 0.408 . . . . 10.0 111.473 -178.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.26 156.8 29.85 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 111.314 -0.715 . . . . 10.0 111.314 178.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 48.2 tp60 -64.88 -22.18 66.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.886 0.374 . . . . 10.0 110.992 -179.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -93.98 17.52 12.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.962 0.41 . . . . 10.0 110.819 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.2 m 62.98 45.8 5.16 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.721 -0.672 . . . . 10.0 111.415 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.3 128.74 38.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.959 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.456 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 3.6 mp0 -92.34 88.06 6.28 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.513 0.673 . . . . 10.0 110.255 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.46 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 12.7 mm -80.97 128.63 38.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.617 -0.72 . . . . 10.0 111.929 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.4 ' O ' ' HA ' ' B' ' 361' ' ' PRO . 10.1 m170 -103.7 89.82 3.46 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.143 -0.688 . . . . 10.0 109.143 178.758 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -92.61 109.54 20.96 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.774 -0.371 . . . . 10.0 110.86 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -88.48 97.28 10.99 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.4 m -98.34 168.15 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.885 -179.196 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 54.1 tttt -118.43 135.33 54.42 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.261 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 45.3 tpp -80.26 77.46 7.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.088 0.471 . . . . 10.0 110.885 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.8 t 177.95 -37.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.222 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.7 148.79 28.8 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.142 179.436 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 13.5 m80 -68.9 153.46 43.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.597 0.237 . . . . 10.0 110.743 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.436 HD12 ' HB3' ' A' ' 75' ' ' HIS . 34.7 mt -69.31 -15.86 63.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.506 -0.315 . . . . 10.0 111.136 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 36.2 tttp -59.25 -46.67 87.88 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.928 -0.397 . . . . 10.0 109.928 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.53 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.5 tppp? -58.7 -32.04 68.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.559 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -74.62 -39.33 62.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.626 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -62.86 -52.5 62.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.899 -0.592 . . . . 10.0 111.789 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.404 ' HG2' ' H ' ' A' ' 49' ' ' GLU . 3.1 pt-20 -64.4 -31.74 73.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.582 -0.281 . . . . 10.0 111.461 -179.03 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 53.9 m -72.92 -34.95 66.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.754 0.311 . . . . 10.0 110.918 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -65.98 -36.06 82.29 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.933 0.397 . . . . 10.0 110.14 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 56.6 m -61.95 -40.27 94.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.947 -0.569 . . . . 10.0 109.782 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -66.45 -31.94 73.0 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.54 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.418 HH21 ' CG ' ' B' ' 360' ' ' ASP . 16.9 tpt180 -68.48 -39.74 81.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.871 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -85.51 -16.71 38.65 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.476 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.63 37.93 13.02 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.817 -0.706 . . . . 10.0 112.398 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 9.1 m -133.61 155.41 80.57 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 110.224 -0.288 . . . . 10.0 110.224 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -70.03 167.69 24.07 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.251 1.967 . . . . 10.0 111.373 179.005 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.7 ttt -74.19 163.52 27.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.608 0.242 . . . . 10.0 110.572 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.2 t30 74.74 0.58 3.6 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.367 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.3 p -86.56 -46.87 9.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.124 0.488 . . . . 10.0 110.036 179.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.2 mt -99.55 131.02 45.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.866 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.528 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 13.2 ptt180 -110.3 128.71 55.67 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.79 179.148 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -88.5 130.27 35.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.937 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.7 mt -113.81 126.22 54.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.067 0.46 . . . . 10.0 110.397 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -135.62 117.32 15.01 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.624 -0.716 . . . . 10.0 109.926 -179.435 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 62.74 18.51 10.71 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.761 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.91 -18.73 49.0 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.604 -0.808 . . . . 10.0 112.911 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -98.31 157.77 15.98 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.621 -0.34 . . . . 10.0 110.639 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -96.2 131.26 42.85 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.339 -0.391 . . . . 10.0 110.308 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 48.8 mm -66.68 121.03 15.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.609 -0.723 . . . . 10.0 111.556 -179.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.95 168.26 13.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.57 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -75.67 -18.5 59.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.217 0.532 . . . . 10.0 110.479 179.759 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -96.29 11.44 34.59 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.946 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.436 ' HB3' HD12 ' A' ' 44' ' ' LEU . 2.5 m170 -90.01 145.7 24.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.235 0.541 . . . . 10.0 111.558 -179.13 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 34.9 p -118.07 155.24 51.52 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.539 -0.755 . . . . 10.0 109.172 178.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_exo -68.96 -7.55 21.09 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.518 2.146 . . . . 10.0 112.805 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -86.51 -33.5 20.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.42 -0.354 . . . . 10.0 111.235 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 11.2 pt-20 -85.48 174.91 9.15 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.619 -0.432 . . . . 10.0 110.006 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.42 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 87.6 mt 73.04 -59.46 0.57 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.318 0.647 . . . . 10.0 110.701 -179.285 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 132.07 61.63 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.592 -0.813 . . . . 10.0 113.033 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 49.5 mtt -98.42 133.59 42.59 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.354 -0.239 . . . . 10.0 110.354 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.2 mm-40 -132.62 -176.96 4.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.183 0.516 . . . . 10.0 111.436 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -70.06 140.1 52.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.154 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 63.95 27.62 14.38 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 123.526 0.516 . . . . 10.0 111.231 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -74.07 171.12 14.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.04 0.448 . . . . 10.0 111.397 -179.432 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.5 t -121.12 132.73 69.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.898 -178.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 20.5 tt -138.89 140.88 37.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 110.165 -0.309 . . . . 10.0 110.165 179.096 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -103.35 156.17 17.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.699 -179.435 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.4 p -143.27 127.27 14.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.112 0.482 . . . . 10.0 110.219 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -136.66 165.23 26.38 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.971 -0.558 . . . . 10.0 110.039 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -90.38 136.81 32.82 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 110.353 -0.239 . . . . 10.0 110.353 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.528 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.1 mm-40 -67.66 164.94 18.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.709 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -68.64 -26.94 65.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.082 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 34.1 p -74.7 -30.86 61.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.36 0.6 . . . . 10.0 110.769 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.98 20.4 67.89 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.208 -0.757 . . . . 10.0 111.208 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.671 -1.072 . . . . 10.0 111.302 -179.596 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 64.2 t30 . . . . . 0 N--CA 1.482 1.153 0 CA-C-O 121.364 0.602 . . . . 10.0 110.492 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 358' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 42.5 t30 -119.15 123.09 43.53 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.265 -1.013 . . . . 10.0 108.265 179.099 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 359' ' ' ARG . . . . . 0.456 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 13.5 ptt180 -124.14 125.4 44.41 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 120.156 -0.617 . . . . 10.0 111.053 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 360' ' ' ASP . . . . . 0.418 ' CG ' HH21 ' A' ' 54' ' ' ARG . 30.9 t0 -124.13 130.18 24.47 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 107.544 -1.28 . . . . 10.0 107.544 176.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 361' ' ' PRO . . . . . 0.4 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 53.0 Cg_endo -108.18 129.51 0.05 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.516 0 C-N-CA 121.969 1.779 . . . . 10.0 111.848 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 10.6 mt -117.35 136.75 53.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 114.695 -1.139 . . . . 10.0 110.276 -178.354 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 11.4 t -112.17 135.69 50.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.984 -178.778 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 364' ' ' ILE . . . . . 0.53 HD11 ' HG3' ' A' ' 46' ' ' LYS . 8.7 tp . . . . . 0 C--N 1.317 -0.807 0 CA-C-N 114.878 -1.055 . . . . 10.0 111.439 -176.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 . . . . . 0 N--CA 1.477 0.905 0 N-CA-C 110.162 -0.31 . . . . 10.0 110.162 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.4 mm -109.68 119.17 58.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 109.408 -0.59 . . . . 10.0 109.408 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.437 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 6.8 ttpm? -96.28 108.65 21.17 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.19 0.519 . . . . 10.0 110.835 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.8 mt -98.3 136.58 38.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.573 179.435 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 78.3 mttt -97.56 112.84 24.54 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.138 0.494 . . . . 10.0 110.596 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.404 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.8 t -91.95 135.24 27.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.153 -179.778 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 32.6 mm -90.72 108.39 19.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.619 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.425 ' HA3' ' OG ' ' A' ' 32' ' ' SER . . . -80.71 150.33 31.03 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.809 -0.71 . . . . 10.0 112.043 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -64.08 -22.67 67.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.846 0.355 . . . . 10.0 111.516 -179.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -96.49 26.73 4.21 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.717 0.294 . . . . 10.0 110.92 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 29.5 m 60.63 45.06 10.76 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.502 0.667 . . . . 10.0 110.864 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.425 ' OG ' ' HA3' ' A' ' 28' ' ' GLY . 3.8 p -106.65 149.48 27.19 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.395 -0.821 . . . . 10.0 110.608 -179.767 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.509 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 28.1 tt0 -108.73 97.34 7.0 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.228 -0.656 . . . . 10.0 109.228 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.404 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 0.8 OUTLIER -86.23 126.24 40.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.658 -178.928 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.8 m170 -101.99 96.79 7.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.114 0.483 . . . . 10.0 109.946 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -89.32 109.98 20.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.923 -0.581 . . . . 10.0 110.425 -179.513 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -89.72 91.56 8.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.321 179.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.415 ' HA ' ' CG2' ' B' ' 364' ' ' ILE . 5.1 m -100.93 -174.54 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.761 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -135.11 143.85 46.83 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.955 -0.387 . . . . 10.0 109.955 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 60.8 tpp -78.42 60.83 2.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.408 0.623 . . . . 10.0 110.555 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.2 m -161.69 -38.76 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.605 -0.725 . . . . 10.0 109.597 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.59 153.61 38.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.482 -0.781 . . . . 10.0 111.628 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -80.07 151.48 29.86 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.387 -0.824 . . . . 10.0 110.019 179.27 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.494 ' HA ' HD23 ' A' ' 47' ' ' LEU . 74.7 mt -72.07 -10.63 60.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.743 0.306 . . . . 10.0 110.758 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -59.91 -46.68 88.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.981 178.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.485 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.9 tppp? -62.99 -41.0 99.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.411 -0.813 . . . . 10.0 110.778 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.494 HD23 ' HA ' ' A' ' 44' ' ' LEU . 1.5 mm? -65.07 -41.58 94.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.915 -178.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -58.79 -47.56 84.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.285 -0.416 . . . . 10.0 112.015 -179.003 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -74.39 -38.22 63.18 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.717 -0.393 . . . . 10.0 111.674 -179.197 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 63.5 m -59.56 -34.01 72.14 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.888 0.375 . . . . 10.0 110.744 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -69.78 -41.66 74.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.332 -0.395 . . . . 10.0 109.937 178.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.563 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 79.4 m -62.1 -43.38 98.95 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.327 -0.397 . . . . 10.0 109.939 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -63.37 -36.38 83.53 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.215 0.531 . . . . 10.0 110.175 179.254 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -65.32 -40.33 93.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.404 179.289 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -77.68 -22.73 50.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.07 -0.513 . . . . 10.0 110.949 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.43 24.96 29.56 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.326 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.5 m -124.07 154.43 68.13 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 110.394 -0.225 . . . . 10.0 110.394 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -61.18 153.05 67.65 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.473 2.116 . . . . 10.0 111.608 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.563 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 17.2 ttt -65.82 152.38 44.51 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 121.232 -0.187 . . . . 10.0 110.889 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.5 t30 82.53 -3.78 1.38 Allowed 'General case' 0 N--CA 1.472 0.644 0 O-C-N 124.175 0.922 . . . . 10.0 111.681 179.09 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.4 p -79.0 -24.35 43.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.202 0.525 . . . . 10.0 110.326 179.43 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.1 mt -117.82 131.48 56.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.124 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.432 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 16.6 ptt-85 -104.1 138.27 40.84 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.322 179.526 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.415 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 73.4 m-85 -100.41 127.26 46.78 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.139 -0.482 . . . . 10.0 109.924 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt -112.17 117.09 31.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.048 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -117.52 107.19 13.98 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.291 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 59.1 34.29 23.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.092 0.472 . . . . 10.0 111.02 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.61 -3.11 87.31 Favored Glycine 0 CA--C 1.518 0.262 0 CA-C-N 115.849 -0.614 . . . . 10.0 113.103 179.532 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -106.7 128.51 54.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.871 0.336 . . . . 10.0 110.494 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.415 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 13.9 ptm180 -76.25 126.66 31.39 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.074 0.464 . . . . 10.0 110.532 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.4 mm -66.78 123.6 20.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.577 -0.738 . . . . 10.0 110.953 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -84.74 170.9 12.79 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.674 -0.693 . . . . 10.0 110.787 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.48 5.54 17.46 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.96 -0.564 . . . . 10.0 111.147 -179.641 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -130.32 18.16 5.41 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.708 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.483 ' HB3' HD12 ' A' ' 44' ' ' LEU . 22.3 m170 -88.94 159.46 17.64 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.07 0.462 . . . . 10.0 111.114 -179.55 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.488 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -131.34 153.47 81.65 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.595 -0.729 . . . . 10.0 110.075 179.678 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.2 -17.82 55.08 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.393 2.062 . . . . 10.0 112.325 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -70.68 -36.67 73.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.925 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 76' ' ' THR . 11.2 pt-20 -85.87 167.23 15.34 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.432 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 84.9 mt 73.79 -51.36 0.69 Allowed 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.208 0.603 . . . . 10.0 110.63 -179.01 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 117.02 61.41 0.31 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.006 -0.616 . . . . 10.0 113.022 178.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 44.4 mtt -87.32 125.05 33.99 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.759 0.314 . . . . 10.0 110.311 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.508 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 7.4 mm-40 -123.74 177.6 5.63 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.135 0.493 . . . . 10.0 111.336 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.437 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 21.7 tp10 -70.25 142.09 52.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.706 179.407 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.436 ' HG2' ' HG3' ' A' ' 84' ' ' GLU . 70.2 mm-40 68.23 25.06 7.31 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 123.464 0.477 . . . . 10.0 111.039 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.508 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.1 t70 -76.52 162.16 28.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.523 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 95.4 t -117.17 125.52 73.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.869 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.4 tt -129.4 137.55 56.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.061 -0.518 . . . . 10.0 109.959 179.503 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -103.49 149.56 24.73 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.898 0.38 . . . . 10.0 111.536 -178.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -132.06 130.89 61.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.835 -0.621 . . . . 10.0 109.808 179.178 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -134.77 157.62 46.28 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.761 0.315 . . . . 10.0 111.138 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -75.4 129.73 37.82 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.679 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.432 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 3.1 mm-40 -79.15 152.65 30.6 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.742 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -77.05 0.15 22.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.707 -0.679 . . . . 10.0 111.433 -178.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.4 p -88.31 -27.86 21.42 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.086 0.469 . . . . 10.0 110.525 179.174 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.09 16.3 80.66 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.674 -179.139 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.945 -0.919 . . . . 10.0 110.965 -179.589 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 29.6 t30 . . . . . 0 N--CA 1.483 1.177 0 CA-C-O 120.458 0.171 . . . . 10.0 110.886 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -120.19 119.83 34.37 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 119.703 -0.799 . . . . 10.0 109.451 178.478 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 359' ' ' ARG . . . . . 0.509 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 18.4 ptt180 -130.01 129.76 44.12 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.377 0.51 . . . . 10.0 112.377 179.06 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 360' ' ' ASP . . . . . 0.41 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 23.8 t70 -121.85 129.96 24.94 Favored Pre-proline 0 C--N 1.316 -0.867 0 N-CA-C 107.31 -1.367 . . . . 10.0 107.31 175.734 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 361' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 71.7 Cg_endo -108.37 129.11 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.107 0 C-N-CA 121.651 1.567 . . . . 10.0 112.581 -179.072 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 7.4 mt -117.84 136.36 55.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 114.182 -1.372 . . . . 10.0 110.735 -177.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 99.3 t -114.28 135.2 54.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 108.509 -0.923 . . . . 10.0 108.509 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 364' ' ' ILE . . . . . 0.485 HD11 ' HG3' ' A' ' 46' ' ' LYS . 8.3 tp . . . . . 0 C--N 1.315 -0.913 0 CA-C-N 114.818 -1.083 . . . . 10.0 112.261 -176.151 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 N--CA 1.481 1.08 0 CA-C-O 120.84 0.353 . . . . 10.0 110.624 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.8 mm -122.44 117.05 50.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 179.276 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.56 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.9 ttpm? -93.15 119.49 32.41 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.132 0.491 . . . . 10.0 111.021 -179.066 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 59.2 mt -102.27 142.38 33.59 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.762 -0.654 . . . . 10.0 110.096 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.3 mtpt -100.12 100.91 11.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.958 0.409 . . . . 10.0 110.481 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.598 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.3 t -86.17 118.01 31.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.8 mm -97.18 112.65 29.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.025 0.441 . . . . 10.0 111.511 -178.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.26 160.09 37.89 Favored Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 110.901 -0.88 . . . . 10.0 110.901 178.348 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -66.74 -19.35 65.73 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.911 0.355 . . . . 10.0 111.354 -179.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.39 27.65 3.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.52 -0.309 . . . . 10.0 111.047 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.0 m 62.28 33.79 16.35 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.51 179.3 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.58 110.14 22.27 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.459 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.4 ' OE1' ' N ' ' B' ' 357' ' ' ASN . 8.7 mt-10 -91.79 98.94 11.92 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.252 -0.647 . . . . 10.0 109.252 178.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.408 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 5.1 mm -87.04 127.82 40.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.467 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.446 ' ND1' ' HE3' ' A' ' 23' ' ' LYS . 14.7 m-70 -103.46 85.66 2.51 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -89.92 119.12 30.02 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.566 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -90.91 101.41 14.17 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.136 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 m -97.57 172.1 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.777 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -123.51 141.31 52.13 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.819 -0.437 . . . . 10.0 109.819 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.499 ' SD ' ' HB2' ' A' ' 77' ' ' PRO . 41.4 tpp -78.26 54.23 1.35 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.078 0.466 . . . . 10.0 111.548 -179.344 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 52.7 m -154.64 -45.15 0.09 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.221 179.533 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.32 153.05 40.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.693 179.85 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -79.25 155.82 28.38 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.005 -0.739 . . . . 10.0 109.005 179.202 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 78.3 mt -69.81 -8.22 46.42 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.78 0.324 . . . . 10.0 111.172 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 47.8 tptt -58.98 -49.47 77.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.989 -0.551 . . . . 10.0 109.98 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.48 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.9 tppp? -59.64 -41.55 90.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.34 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.46 -40.22 95.28 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.418 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -63.95 -45.31 89.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.321 -0.4 . . . . 10.0 112.053 -179.217 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -73.7 -39.29 64.46 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.668 -0.413 . . . . 10.0 111.536 -179.026 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.476 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 67.6 m -64.92 -32.47 74.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.825 0.345 . . . . 10.0 111.09 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -65.62 -38.46 89.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.057 0.456 . . . . 10.0 110.391 179.308 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.507 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 60.2 m -63.01 -36.07 82.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.714 -0.676 . . . . 10.0 110.138 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.476 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 74.2 mt-30 -67.91 -34.18 76.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.802 -0.635 . . . . 10.0 110.515 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -67.43 -38.44 84.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.578 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -80.89 -34.48 33.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.309 -179.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 99.97 37.13 3.98 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.69 -0.767 . . . . 10.0 112.168 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.448 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 2.5 m -137.1 155.82 75.89 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 109.984 -0.376 . . . . 10.0 109.984 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -69.17 155.19 68.65 Favored 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.18 1.92 . . . . 10.0 111.382 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.507 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 11.9 ttt -64.09 158.02 23.87 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 121.097 -0.241 . . . . 10.0 111.176 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.6 t30 81.03 -0.48 1.76 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.75 0.82 . . . . 10.0 111.461 179.327 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 57.1 p -86.25 -29.5 23.06 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.17 0.509 . . . . 10.0 110.441 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 25.0 mt -119.06 140.47 50.01 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.795 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.479 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 21.4 ptt-85 -117.44 141.59 48.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.159 179.225 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.467 ' HB3' HD11 ' A' ' 88' ' ' ILE . 93.4 m-85 -96.83 129.72 44.22 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.138 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt -107.58 116.07 31.29 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.963 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -124.68 113.31 17.82 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 61.56 32.55 18.64 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 123.484 0.49 . . . . 10.0 110.964 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.67 -13.79 57.61 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.018 -0.61 . . . . 10.0 113.104 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -100.27 147.35 25.85 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.913 0.387 . . . . 10.0 110.651 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -89.33 126.69 35.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.004 0.43 . . . . 10.0 110.523 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 42.9 mm -63.77 125.26 20.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.568 -0.742 . . . . 10.0 111.191 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.64 -179.25 7.27 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.946 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 1.5 m-20 -88.92 -2.6 58.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.49 -0.323 . . . . 10.0 111.338 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -119.37 12.07 12.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.683 0.278 . . . . 10.0 111.142 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -84.16 153.89 23.42 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.112 0.482 . . . . 10.0 111.722 -179.131 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.447 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 35.6 p -124.73 157.48 65.77 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.55 -0.75 . . . . 10.0 109.636 178.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' PRO . . . . . 0.499 ' HB2' ' SD ' ' A' ' 40' ' ' MET . 14.9 Cg_exo -69.23 -12.54 34.15 Favored 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 122.382 2.055 . . . . 10.0 112.692 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -77.07 -41.24 43.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.641 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.6 pt-20 -77.94 160.17 28.39 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 179.243 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 33.9 mt 73.69 -43.65 0.55 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.506 0.504 . . . . 10.0 110.379 -178.845 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 105.18 74.72 0.96 Allowed Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.965 -0.636 . . . . 10.0 113.55 178.407 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 36.6 mtt -96.74 131.74 43.15 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.688 -0.486 . . . . 10.0 109.688 178.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.547 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.3 mm-40 -129.9 179.01 6.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.939 0.4 . . . . 10.0 111.47 -179.492 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.56 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 20.7 tp10 -69.0 142.41 54.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.587 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 66.39 19.89 10.96 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 123.687 0.617 . . . . 10.0 111.249 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.547 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.8 OUTLIER -69.78 138.73 52.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.29 -0.413 . . . . 10.0 110.144 179.96 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.7 t -93.82 120.03 42.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.859 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.598 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 18.3 tt -133.28 139.48 49.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 179.387 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -112.15 154.28 25.73 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.901 0.382 . . . . 10.0 111.114 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.7 p -128.53 136.21 60.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.802 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -135.59 157.14 47.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.583 0.23 . . . . 10.0 110.823 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -74.41 136.61 42.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.553 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.479 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 6.1 mm-40 -71.39 161.54 30.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.905 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -65.37 -34.04 77.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.827 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.3 p -69.96 -30.2 67.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.002 0.43 . . . . 10.0 110.704 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.27 3.42 87.14 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 121.048 -0.596 . . . . 10.0 111.933 -179.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.961 0 CA-C-O 118.745 -1.031 . . . . 10.0 111.13 -179.889 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 357' ' ' ASN . . . . . 0.4 ' N ' ' OE1' ' A' ' 33' ' ' GLU . 4.8 p-10 . . . . . 0 N--CA 1.483 1.192 0 N-CA-C 111.395 0.146 . . . . 10.0 111.395 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -119.88 123.76 44.39 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 109.033 -0.729 . . . . 10.0 109.033 179.049 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -125.49 126.47 44.94 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.963 0.727 . . . . 10.0 112.963 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 360' ' ' ASP . . . . . 0.45 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 39.2 t70 -126.67 127.42 24.49 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 175.538 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 361' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 61.4 Cg_endo -110.92 126.03 0.03 OUTLIER 'Trans proline' 0 CA--C 1.536 0.593 0 C-N-CA 121.926 1.75 . . . . 10.0 113.414 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 3.4 mt -122.97 136.73 58.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 114.908 -1.042 . . . . 10.0 110.409 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 43.4 t -113.54 135.66 52.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.014 0.435 . . . . 10.0 110.006 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 364' ' ' ILE . . . . . 0.48 HD11 ' HG3' ' A' ' 46' ' ' LYS . 7.1 tp . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 115.242 -0.89 . . . . 10.0 111.428 -176.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 109.709 -0.478 . . . . 10.0 109.709 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.502 ' O ' HG22 ' A' ' 38' ' ' VAL . 34.1 mm -73.35 112.25 9.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.954 0.407 . . . . 10.0 110.553 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.507 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -97.18 101.11 12.61 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.102 0.477 . . . . 10.0 110.114 179.601 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 69.9 mt -82.89 157.54 23.04 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.738 -0.664 . . . . 10.0 110.37 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 34' ' ' ILE . 77.8 tttt -120.94 109.03 14.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.938 0.399 . . . . 10.0 110.675 179.437 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.482 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 3.2 t -92.23 128.05 44.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 179.108 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.1 mm -107.22 122.44 61.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.897 0.379 . . . . 10.0 111.068 -179.44 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -100.78 167.85 20.08 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.756 179.129 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -65.74 -16.14 63.5 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.231 0.538 . . . . 10.0 110.994 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.2 p-10 -92.24 18.41 8.28 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.254 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.2 m 58.08 42.78 21.88 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.413 0.625 . . . . 10.0 110.96 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -90.75 149.32 22.06 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.322 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.518 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 42.5 mt-10 -116.91 86.95 2.6 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.249 -0.649 . . . . 10.0 109.249 178.189 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.482 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 44.2 mm -79.04 118.69 26.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.151 -179.414 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 20.6 m170 -102.16 89.29 3.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.947 -0.76 . . . . 10.0 108.947 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -92.03 116.0 28.55 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.854 -178.926 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -90.44 97.88 11.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.035 -0.529 . . . . 10.0 109.587 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.502 HG22 ' O ' ' A' ' 22' ' ' ILE . 2.8 m -100.77 170.42 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.61 -179.488 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.1 tttt -122.33 141.07 51.93 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.404 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 62.3 tpp -79.37 75.14 5.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.559 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -176.92 -41.8 0.01 OUTLIER 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.383 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.93 147.49 36.93 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.764 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.7 m80 -75.61 153.37 37.33 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 53.6 mt -69.93 -4.97 22.96 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.752 0.31 . . . . 10.0 111.324 -179.406 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 46.2 tptt -61.36 -48.79 79.66 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.536 ' HG3' HD11 ' B' ' 364' ' ' ILE . 4.2 tppp? -62.91 -35.23 79.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.276 -0.874 . . . . 10.0 110.256 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.77 -46.97 70.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.683 -0.69 . . . . 10.0 111.031 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -60.57 -44.16 96.49 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.998 -0.546 . . . . 10.0 112.11 -179.089 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -70.81 -41.93 70.92 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.97 -0.292 . . . . 10.0 111.655 -178.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.9 m -64.47 -32.47 74.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.705 0.288 . . . . 10.0 111.222 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -68.77 -35.02 76.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.848 0.356 . . . . 10.0 110.24 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.492 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 85.6 m -62.37 -40.02 95.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.181 0.515 . . . . 10.0 109.927 179.211 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -67.36 -30.73 70.61 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.364 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -68.27 -30.0 68.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.221 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -98.48 -4.95 33.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.319 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.63 36.88 62.03 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.878 -0.677 . . . . 10.0 112.54 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 13.4 m -130.5 152.53 80.49 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 110.067 -0.346 . . . . 10.0 110.067 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -69.82 158.16 57.81 Favored 'Trans proline' 0 N--CA 1.466 -0.13 0 C-N-CA 122.256 1.971 . . . . 10.0 111.443 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.492 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 12.0 ttt -66.74 157.65 32.25 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.959 -0.296 . . . . 10.0 110.348 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.9 t30 79.06 -5.88 1.95 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.483 0.713 . . . . 10.0 111.46 179.369 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.4 p -81.72 -24.16 36.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.855 0.359 . . . . 10.0 110.832 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 79.2 mt -119.02 143.36 47.12 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.907 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.505 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 16.5 ptt-85 -116.18 128.14 55.38 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.172 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -90.8 128.31 36.66 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.05 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.7 mt -111.01 131.22 55.23 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.62 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -143.03 117.41 9.64 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.56 -0.745 . . . . 10.0 109.97 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 61.07 29.66 19.05 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.782 -0.645 . . . . 10.0 111.883 179.601 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.41 -4.77 85.89 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.71 -0.757 . . . . 10.0 112.784 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -112.78 156.2 23.27 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.187 -0.301 . . . . 10.0 110.187 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -95.66 134.96 37.96 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.072 0.463 . . . . 10.0 110.679 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 37.3 mm -71.79 115.88 12.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.478 -0.783 . . . . 10.0 110.321 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.41 167.05 21.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.169 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.59 11.17 2.18 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.765 -178.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -133.56 11.96 4.09 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.107 0.479 . . . . 10.0 110.325 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -81.93 151.7 27.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.521 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 31.9 p -125.02 153.46 71.27 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.003 179.18 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -66.96 -12.51 36.39 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 122.461 2.107 . . . . 10.0 112.454 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -75.8 -35.82 59.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.706 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 76' ' ' THR . 9.9 pt-20 -91.25 170.26 10.15 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.827 -0.434 . . . . 10.0 109.827 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mt 72.63 -49.79 0.7 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.261 0.625 . . . . 10.0 110.999 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.82 76.26 0.59 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 121.022 -0.608 . . . . 10.0 112.496 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 34.9 mtt -106.52 123.77 48.59 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.997 -0.372 . . . . 10.0 109.997 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.547 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 5.1 mm-40 -122.17 178.87 4.74 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.307 0.575 . . . . 10.0 112.013 -179.298 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.507 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 28.3 tp10 -67.7 137.58 55.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.462 -0.79 . . . . 10.0 109.945 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 65.3 27.79 11.99 Favored 'General case' 0 N--CA 1.464 0.249 0 O-C-N 123.61 0.569 . . . . 10.0 111.112 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.547 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.6 t0 -77.0 142.08 40.08 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.305 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 29.6 t -91.45 120.88 41.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.055 -0.521 . . . . 10.0 111.37 -179.22 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 15.3 tt -129.49 142.78 43.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 108.954 -0.758 . . . . 10.0 108.954 178.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -119.14 153.61 34.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.029 0.442 . . . . 10.0 111.449 -178.799 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.9 p -135.73 133.84 51.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.851 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -134.04 164.3 27.64 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.617 -0.265 . . . . 10.0 110.677 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -72.87 134.31 44.78 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.481 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.505 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 0.7 OUTLIER -72.08 164.48 26.08 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.231 179.931 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -68.06 -36.45 79.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.502 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.0 p -71.18 -30.26 66.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.11 0.481 . . . . 10.0 111.008 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.73 5.4 89.88 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.579 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.829 -0.984 . . . . 10.0 111.012 -179.802 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 22.0 m120 . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.512 0.196 . . . . 10.0 111.228 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 358' ' ' ASN . . . . . 0.518 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 54.5 t30 -119.6 119.62 34.31 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 177.47 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 359' ' ' ARG . . . . . 0.5 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 14.1 ptt85 -126.59 129.58 48.82 Favored 'General case' 0 CA--C 1.506 -0.722 0 C-N-CA 119.857 -0.737 . . . . 10.0 112.094 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 360' ' ' ASP . . . . . 0.435 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 31.7 t70 -121.8 132.48 24.23 Favored Pre-proline 0 C--N 1.311 -1.09 0 N-CA-C 107.298 -1.371 . . . . 10.0 107.298 177.665 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 361' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 58.5 Cg_endo -106.81 129.69 0.05 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.438 0 C-N-CA 121.914 1.742 . . . . 10.0 112.328 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 9.5 mt -118.97 136.92 54.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 113.884 -1.507 . . . . 10.0 110.774 -178.283 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 52.6 t -113.39 135.07 54.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.295 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 364' ' ' ILE . . . . . 0.536 HD11 ' HG3' ' A' ' 46' ' ' LYS . 9.3 tp . . . . . 0 C--N 1.32 -0.697 0 CA-C-N 114.951 -1.022 . . . . 10.0 110.546 -176.476 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 110.178 -0.304 . . . . 10.0 110.178 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.7 mm -112.82 117.51 55.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.778 -0.453 . . . . 10.0 109.778 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.7 OUTLIER -97.06 102.95 14.84 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.138 0.494 . . . . 10.0 110.796 -179.463 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 45.3 mt -82.79 146.96 28.67 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.872 -0.604 . . . . 10.0 109.808 179.668 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.7 ttpt -110.95 99.54 8.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.011 0.434 . . . . 10.0 109.986 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.456 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.9 t -78.16 133.05 31.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.929 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.434 ' HB ' ' HG2' ' A' ' 89' ' ' GLU . 15.4 mm -92.1 110.29 22.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.902 -179.345 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.441 ' HA3' ' OG ' ' A' ' 32' ' ' SER . . . -83.0 160.49 38.8 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.625 -0.798 . . . . 10.0 112.053 179.208 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -64.02 -31.97 73.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.791 0.329 . . . . 10.0 111.334 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -92.03 25.85 2.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.055 0.455 . . . . 10.0 110.468 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.1 m 63.4 32.95 14.17 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.502 -0.772 . . . . 10.0 111.003 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.441 ' OG ' ' HA3' ' A' ' 28' ' ' GLY . 0.3 OUTLIER -84.9 129.94 34.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.526 -0.761 . . . . 10.0 109.989 179.397 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -97.99 94.83 7.08 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.591 -0.522 . . . . 10.0 109.591 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.456 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 4.6 mm -77.9 121.75 31.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.209 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.6 m170 -101.97 89.24 3.57 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.276 -0.42 . . . . 10.0 109.88 -179.658 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.413 ' CD2' HD12 ' B' ' 362' ' ' ILE . 0.1 OUTLIER -96.29 118.48 32.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.296 -179.663 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -91.57 102.02 14.67 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.387 -0.369 . . . . 10.0 110.174 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.2 m -100.4 170.94 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.587 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -123.16 135.44 54.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.063 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.412 ' O ' ' HB ' ' A' ' 41' ' ' THR . 60.8 tpp -75.49 74.39 2.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.038 -179.369 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.412 ' HB ' ' O ' ' A' ' 40' ' ' MET . 15.0 t 178.25 -30.96 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.481 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.68 153.27 22.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.895 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -75.78 150.47 37.75 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.114 179.596 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 34.8 mt -70.0 -9.96 56.99 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.327 -0.397 . . . . 10.0 111.494 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.9 tptt -59.78 -47.18 86.74 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 178.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.47 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.6 tppp? -60.49 -29.74 69.26 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.65 -0.705 . . . . 10.0 110.59 179.749 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 47' ' ' LEU . 3.8 mm? -79.66 -41.07 27.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.229 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -65.56 -35.36 80.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.268 -0.424 . . . . 10.0 111.111 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.418 ' OE2' ' HG3' ' A' ' 59' ' ' MET . 2.6 mm-40 -71.38 -43.85 66.09 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.103 -179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.3 p -66.57 -37.8 85.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.685 -178.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -59.86 -45.13 93.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.698 0.285 . . . . 10.0 110.454 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.448 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.3 m -60.45 -42.63 96.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.049 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -63.68 -38.45 91.15 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.45 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 -65.38 -36.74 84.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.398 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -76.04 -20.59 57.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.969 -0.559 . . . . 10.0 110.375 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 86.53 26.99 31.13 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.787 -0.642 . . . . 10.0 112.525 179.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.2 m -131.93 158.82 74.44 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 110.453 -0.203 . . . . 10.0 110.453 -179.482 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.23 166.01 18.08 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.452 2.101 . . . . 10.0 112.02 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.448 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 0.2 OUTLIER -72.2 159.39 34.19 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.907 -179.621 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 t30 69.31 13.81 8.52 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.328 0.651 . . . . 10.0 111.49 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 38.9 p -89.2 -22.69 22.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.255 0.55 . . . . 10.0 109.776 178.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 mt -127.7 142.24 51.38 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.482 -0.781 . . . . 10.0 110.591 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.7 ptt-85 -112.05 130.65 55.8 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.013 -0.539 . . . . 10.0 110.024 179.366 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.491 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 98.0 m-85 -90.65 131.99 36.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.439 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 93.7 mt -113.97 120.11 39.53 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.14 0.495 . . . . 10.0 111.03 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -127.24 112.73 15.44 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.554 -0.906 . . . . 10.0 108.554 179.525 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 65.65 25.6 11.56 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.089 0.471 . . . . 10.0 110.265 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.92 -14.77 62.45 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.753 -0.658 . . . . 10.0 112.749 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -98.85 148.07 24.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.776 0.322 . . . . 10.0 110.809 -179.157 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.491 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 14.2 ptm180 -85.3 132.19 34.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.964 0.411 . . . . 10.0 110.519 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 41.8 mm -71.24 127.1 32.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.224 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.3 -173.7 3.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.647 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -93.22 -33.36 14.01 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.035 0.445 . . . . 10.0 110.698 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -90.3 4.91 49.34 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.779 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -73.57 147.11 44.21 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.637 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.561 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -124.97 151.22 68.51 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.876 179.479 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -62.65 -15.86 49.06 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.527 2.151 . . . . 10.0 112.413 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -64.92 -41.92 95.14 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.285 179.534 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 76' ' ' THR . 7.7 pt-20 -89.11 171.67 9.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.806 -0.634 . . . . 10.0 109.599 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 18.3 mt 73.23 -49.49 0.69 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.689 0.618 . . . . 10.0 111.139 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.39 76.57 0.83 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 121.101 -0.571 . . . . 10.0 112.27 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 43.9 mtt -106.43 125.67 51.29 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.718 0.294 . . . . 10.0 110.38 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.502 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.2 mm-40 -124.75 178.61 5.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.04 0.448 . . . . 10.0 111.235 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.477 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 19.2 tp10 -67.86 138.67 56.25 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.476 179.755 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 64.51 26.34 13.37 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 123.614 0.571 . . . . 10.0 111.429 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.502 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -71.17 155.6 40.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.421 179.919 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 57.3 t -99.15 120.82 49.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.135 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 11.4 tt -136.45 136.59 48.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.225 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.434 ' HG2' ' HB ' ' A' ' 27' ' ' ILE . 60.7 mt-10 -113.07 159.25 19.38 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.795 0.331 . . . . 10.0 111.081 -179.298 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.3 p -142.16 131.19 22.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.425 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -131.16 158.69 39.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.402 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -71.24 138.0 49.09 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.82 0.343 . . . . 10.0 110.937 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -75.08 160.78 30.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.857 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -64.9 -42.65 94.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.991 -0.549 . . . . 10.0 110.313 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.97 -40.71 96.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.571 -0.74 . . . . 10.0 111.5 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 99.8 -16.23 58.78 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.825 -0.702 . . . . 10.0 112.458 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.001 0 CA-C-O 119.174 -0.792 . . . . 10.0 111.551 -179.946 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 65.4 t30 . . . . . 0 N--CA 1.487 1.413 0 CA-C-O 121.028 0.442 . . . . 10.0 110.79 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -120.88 121.35 37.9 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.291 -1.003 . . . . 10.0 108.291 178.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 23.9 ptt180 -127.51 130.14 48.65 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 112.454 0.538 . . . . 10.0 112.454 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 360' ' ' ASP . . . . . 0.45 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 31.0 t70 -120.12 128.79 25.66 Favored Pre-proline 0 C--N 1.317 -0.842 0 N-CA-C 105.632 -1.988 . . . . 10.0 105.632 175.524 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 361' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 48.8 Cg_endo -108.64 127.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.237 0 C-N-CA 121.542 1.494 . . . . 10.0 113.688 -177.754 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 362' ' ' ILE . . . . . 0.413 HD12 ' CD2' ' A' ' 36' ' ' PHE . 1.7 mt -121.19 134.54 64.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 114.147 -1.388 . . . . 10.0 110.182 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 77.8 t -114.68 136.43 51.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.18 -0.674 . . . . 10.0 109.18 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 364' ' ' ILE . . . . . 0.47 HD11 ' HG3' ' A' ' 46' ' ' LYS . 7.9 tp . . . . . 0 C--N 1.315 -0.91 0 CA-C-N 114.766 -1.107 . . . . 10.0 111.316 -176.278 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 . . . . . 0 N--CA 1.479 1.021 0 CA-C-O 120.692 0.282 . . . . 10.0 110.271 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.0 mm -122.78 108.4 21.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.504 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.7 OUTLIER -94.82 106.17 18.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.218 0.532 . . . . 10.0 110.677 -179.667 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 30.5 mt -90.76 146.92 23.58 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.231 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.9 mtpt -109.44 105.51 14.89 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.932 -0.395 . . . . 10.0 109.932 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.501 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.5 t -86.7 131.4 34.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.739 179.627 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.5 mm -84.83 104.41 12.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.278 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -72.25 152.13 47.87 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.82 -0.705 . . . . 10.0 112.172 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -61.2 -28.97 69.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.823 0.345 . . . . 10.0 110.981 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -96.14 23.94 6.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.754 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 m 64.77 34.41 9.5 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.089 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.2 p -92.47 142.5 27.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.475 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.436 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 24.4 mt-10 -98.12 102.34 14.06 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.947 -0.39 . . . . 10.0 109.947 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.501 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 9.1 mm -87.49 117.04 30.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.332 -0.395 . . . . 10.0 110.331 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -97.03 92.62 6.16 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.856 -0.424 . . . . 10.0 109.856 179.553 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.34 108.03 20.48 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.993 -0.373 . . . . 10.0 109.993 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -88.28 102.26 14.66 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.795 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -101.84 167.51 2.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.119 -0.492 . . . . 10.0 111.091 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 67.6 tttt -115.82 133.06 56.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.004 -0.544 . . . . 10.0 109.559 179.643 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.508 ' O ' ' HB ' ' A' ' 41' ' ' THR . 59.5 tpp -75.47 80.33 2.51 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.363 -0.38 . . . . 10.0 111.127 -179.218 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.508 ' HB ' ' O ' ' A' ' 40' ' ' MET . 14.7 t 172.04 -27.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.371 179.195 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.7 150.69 26.59 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.861 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.3 m80 -71.09 144.89 50.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.363 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.434 ' HA ' HD23 ' A' ' 47' ' ' LEU . 19.0 mt -67.71 -12.8 61.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.966 0.412 . . . . 10.0 110.293 179.685 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.8 tptt -57.91 -47.93 81.39 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.794 178.302 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.46 ' HG3' HD11 ' B' ' 364' ' ' ILE . 4.9 tppp? -62.57 -33.56 75.2 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.178 -0.919 . . . . 10.0 110.708 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' A' ' 44' ' ' LEU . 3.3 mm? -71.33 -37.48 71.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.873 -179.629 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -68.87 -46.6 68.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.773 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.433 ' OE1' ' HA ' ' A' ' 46' ' ' LYS . 14.8 pt-20 -66.68 -43.41 84.55 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.586 0.217 . . . . 10.0 111.586 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.439 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 19.3 m -64.15 -33.47 75.85 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.809 0.3 . . . . 10.0 111.809 -179.164 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -65.06 -42.7 93.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.791 0.329 . . . . 10.0 110.298 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.428 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 39.6 m -61.81 -39.46 91.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.183 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.439 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.4 mt-30 -63.68 -36.92 85.42 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.359 179.492 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -67.38 -37.51 83.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.546 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -79.67 -13.74 59.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.943 -0.571 . . . . 10.0 111.003 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.59 27.92 56.18 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.254 -0.498 . . . . 10.0 112.687 179.478 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.5 m -129.25 151.27 77.49 Favored Pre-proline 0 C--N 1.328 -0.365 0 O-C-N 122.663 -0.316 . . . . 10.0 110.698 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.84 151.73 75.18 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.504 2.136 . . . . 10.0 111.678 179.369 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.428 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 19.4 ttt -63.81 159.24 19.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.495 -0.321 . . . . 10.0 111.058 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 78.18 4.07 2.77 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.662 0.785 . . . . 10.0 111.751 179.104 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.3 p -92.43 -20.21 21.25 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.874 0.369 . . . . 10.0 111.017 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.1 mt -116.75 136.54 52.88 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.279 -0.418 . . . . 10.0 111.245 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.442 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 28.0 ptt-85 -105.91 131.49 53.15 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.909 179.152 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -99.13 119.56 38.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.833 -0.621 . . . . 10.0 109.777 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.7 mt -108.73 114.89 29.06 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.239 0.542 . . . . 10.0 111.385 -178.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -123.18 118.8 28.47 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.368 -0.975 . . . . 10.0 108.368 178.684 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 64.66 20.16 12.05 Favored 'General case' 0 N--CA 1.464 0.231 0 O-C-N 123.544 0.527 . . . . 10.0 110.342 -178.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.93 -13.12 68.1 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 115.755 -0.657 . . . . 10.0 112.719 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -98.17 150.84 21.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.822 0.344 . . . . 10.0 111.016 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 70' ' ' ARG . 11.7 ptm180 -88.97 124.73 34.53 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.432 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.1 mm -66.04 126.73 25.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.614 -0.721 . . . . 10.0 111.022 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -84.15 -179.88 7.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.621 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.21 -5.94 57.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.901 0.381 . . . . 10.0 111.099 -179.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -113.38 14.7 19.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.995 0.426 . . . . 10.0 110.666 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 20.1 m170 -87.16 158.31 19.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.397 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.548 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 10.6 p -134.13 154.71 80.26 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.435 -0.802 . . . . 10.0 109.399 178.77 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.02 -9.59 25.57 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.352 2.035 . . . . 10.0 112.121 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -71.6 -34.19 69.66 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.6 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.548 ' HG2' ' O ' ' A' ' 76' ' ' THR . 5.5 pt-20 -92.78 171.99 8.63 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.006 -0.368 . . . . 10.0 110.006 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.7 mt 73.13 -44.45 0.59 Allowed 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.829 0.706 . . . . 10.0 111.051 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 107.87 60.53 0.56 Allowed Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 121.228 -0.511 . . . . 10.0 111.96 179.601 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 47.9 mtt -87.63 126.62 35.06 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.031 -0.359 . . . . 10.0 110.031 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.466 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 18.0 mm-40 -130.51 178.59 6.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.335 0.588 . . . . 10.0 112.136 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.504 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 20.3 tp10 -67.85 137.69 55.5 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.323 -0.853 . . . . 10.0 110.333 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 5.9 mm-40 69.46 26.64 5.13 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.615 0.572 . . . . 10.0 111.607 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.466 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.3 OUTLIER -80.98 146.87 30.49 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.956 -0.387 . . . . 10.0 109.956 179.343 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 98.5 t -100.64 127.67 53.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.206 -0.452 . . . . 10.0 111.0 -179.229 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.4 tt -132.2 146.63 32.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.654 -0.498 . . . . 10.0 109.654 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -110.34 152.22 26.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.848 0.356 . . . . 10.0 111.48 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 10.6 p -141.12 130.0 24.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.932 179.088 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -135.62 164.29 28.17 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.493 -0.322 . . . . 10.0 110.385 -179.523 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -83.4 132.07 35.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.771 0.319 . . . . 10.0 110.584 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.442 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.8 mm-40 -72.72 156.12 39.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.013 -0.54 . . . . 10.0 111.55 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -70.22 -22.0 62.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.492 -0.776 . . . . 10.0 111.273 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.9 p -77.34 -19.5 56.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.933 0.397 . . . . 10.0 111.241 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 74.19 10.71 81.73 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.741 -0.742 . . . . 10.0 111.642 -179.384 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.93 0 CA-C-O 118.65 -1.083 . . . . 10.0 111.202 -179.709 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 64.7 t30 . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 121.046 0.45 . . . . 10.0 110.76 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 358' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 52.8 t30 -119.15 121.42 39.71 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 108.189 -1.041 . . . . 10.0 108.189 178.491 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 359' ' ' ARG . . . . . 0.417 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 24.9 ptt180 -128.73 130.22 46.81 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.642 0.608 . . . . 10.0 112.642 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 360' ' ' ASP . . . . . 0.469 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 32.9 t70 -119.87 131.49 24.39 Favored Pre-proline 0 C--N 1.318 -0.769 0 N-CA-C 107.018 -1.475 . . . . 10.0 107.018 175.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 361' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 68.5 Cg_endo -109.63 128.95 0.04 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 121.775 1.65 . . . . 10.0 113.911 -178.109 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 3.0 mt -118.1 135.72 57.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 114.316 -1.311 . . . . 10.0 110.1 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 59.0 t -114.68 136.61 50.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 108.889 -0.782 . . . . 10.0 108.889 -179.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 364' ' ' ILE . . . . . 0.46 HD11 ' HG3' ' A' ' 46' ' ' LYS . 6.4 tp . . . . . 0 C--N 1.316 -0.882 0 CA-C-N 115.354 -0.839 . . . . 10.0 112.149 -175.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 . . . . . 0 N--CA 1.479 1.0 0 CA-C-O 120.714 0.292 . . . . 10.0 110.517 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 32.4 mm -105.81 126.62 61.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.124 -0.489 . . . . 10.0 109.774 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.427 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.4 ttpm? -99.56 97.74 8.69 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.088 0.471 . . . . 10.0 110.546 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 69.5 mt -84.77 144.84 28.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.334 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.5 mtpt -102.53 107.78 18.86 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.932 0.396 . . . . 10.0 110.696 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.43 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 3.0 t -91.05 122.07 42.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 109.078 -0.712 . . . . 10.0 109.078 178.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 39.1 mm -91.15 108.59 20.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 120.933 0.397 . . . . 10.0 111.158 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.97 158.03 49.28 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.767 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 -63.71 -22.09 66.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.63 0.252 . . . . 10.0 111.556 -178.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -103.41 28.63 6.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.794 0.33 . . . . 10.0 111.42 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.7 m 65.69 27.53 11.29 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.693 -0.685 . . . . 10.0 112.243 178.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.29 125.8 35.25 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.558 -0.534 . . . . 10.0 109.558 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -97.5 102.54 14.33 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.19 0.519 . . . . 10.0 110.627 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.43 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 2.9 mm -89.67 129.83 39.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.522 -179.22 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.2 m170 -103.7 94.82 5.65 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -91.09 116.02 28.48 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.371 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -86.56 99.65 11.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.179 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.458 HG12 HD11 ' A' ' 47' ' ' LEU . 3.4 m -104.06 171.48 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.936 -179.212 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 49.5 tttm -127.41 140.02 52.44 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.493 ' SD ' ' HB2' ' A' ' 77' ' ' PRO . 43.9 tpp -75.55 63.68 1.55 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.226 0.536 . . . . 10.0 110.609 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.9 m -161.42 -40.14 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.676 -0.693 . . . . 10.0 109.663 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.2 163.36 27.14 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.32 -0.854 . . . . 10.0 111.983 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -90.47 153.62 20.25 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.182 -0.917 . . . . 10.0 109.768 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.5 mt -72.72 -10.6 59.99 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.163 -0.215 . . . . 10.0 111.146 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 30.8 tptt -60.36 -47.31 86.63 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.281 -0.637 . . . . 10.0 109.281 177.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -62.92 -37.2 86.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.144 -0.935 . . . . 10.0 110.486 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.458 HD11 HG12 ' A' ' 38' ' ' VAL . 3.3 mm? -69.14 -45.31 70.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.319 -179.584 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -60.01 -47.15 87.02 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.222 -0.445 . . . . 10.0 112.063 -179.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -69.27 -37.69 78.02 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 121.051 -0.259 . . . . 10.0 111.584 -178.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.452 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 45.8 m -66.09 -35.65 81.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.852 0.358 . . . . 10.0 111.391 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -66.65 -35.49 80.29 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.495 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 64.5 m -63.86 -35.24 79.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.953 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.452 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 64.2 mt-30 -71.02 -33.71 70.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.178 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.64 -32.99 74.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.599 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -92.15 -29.29 16.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.264 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 97.1 33.08 6.14 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 120.741 -0.742 . . . . 10.0 112.442 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.8 m -128.39 156.96 76.09 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 110.262 -0.273 . . . . 10.0 110.262 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -68.87 156.54 65.08 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.125 1.884 . . . . 10.0 111.197 179.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.495 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 12.1 ttt -67.02 156.43 36.05 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.962 -0.295 . . . . 10.0 110.38 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.4 t30 79.78 -0.27 2.14 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 123.932 0.77 . . . . 10.0 111.697 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 76.0 p -85.89 -27.84 24.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.141 0.496 . . . . 10.0 110.089 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 63.1 mt -112.31 129.83 56.16 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.744 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.474 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.6 ptt-85 -100.86 129.97 46.81 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.798 179.213 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -96.82 117.86 32.0 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.5 mt -103.66 124.55 49.04 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.336 0.588 . . . . 10.0 111.128 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -127.51 105.38 8.46 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.186 -0.915 . . . . 10.0 109.227 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 65.54 25.13 11.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.459 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.98 -11.37 65.98 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.927 -0.654 . . . . 10.0 112.958 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -101.4 148.62 24.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.782 0.291 . . . . 10.0 110.285 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 70' ' ' ARG . 9.6 ptm180 -89.3 131.43 35.4 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.99 0.424 . . . . 10.0 110.376 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 45.7 mm -69.89 120.91 18.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.217 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -85.19 169.19 14.08 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.326 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.409 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 38.7 m-20 -72.62 -30.75 64.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.905 0.383 . . . . 10.0 111.237 -179.353 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 18.1 p-10 -91.23 9.38 31.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.877 0.37 . . . . 10.0 111.146 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.407 ' HB2' ' O ' ' A' ' 72' ' ' ALA . 1.4 m170 -74.94 148.97 39.56 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.107 0.48 . . . . 10.0 110.765 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.606 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -133.59 145.42 56.22 Favored Pre-proline 0 C--N 1.32 -0.689 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.082 179.33 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.493 ' HB2' ' SD ' ' A' ' 40' ' ' MET . 31.6 Cg_exo -59.04 -13.27 18.3 Favored 'Trans proline' 0 N--CA 1.477 0.522 0 C-N-CA 122.834 2.356 . . . . 10.0 112.991 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -73.7 -27.57 61.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.558 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.606 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.0 pt-20 -98.65 172.45 7.47 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.694 -0.484 . . . . 10.0 109.694 179.513 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 31.5 mt 72.26 -55.9 0.66 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.685 0.616 . . . . 10.0 110.989 -179.498 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 121.27 66.42 0.25 Allowed Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 121.076 -0.583 . . . . 10.0 112.377 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 60.6 mtt -96.78 137.4 35.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.555 0.217 . . . . 10.0 110.497 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.475 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 2.4 mm-40 -138.04 -173.04 3.4 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.042 0.449 . . . . 10.0 111.307 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.427 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 24.6 tp10 -73.67 140.58 46.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.001 -0.545 . . . . 10.0 109.909 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 68.25 23.59 7.75 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.604 0.565 . . . . 10.0 110.682 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.5 t0 -72.18 152.53 42.2 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.071 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 41.3 t -107.19 122.66 61.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.439 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.9 tt -126.27 134.34 66.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -103.34 145.92 29.24 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.771 0.32 . . . . 10.0 111.312 -178.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -126.99 125.31 66.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.115 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -130.19 157.31 42.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.608 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -82.97 131.74 35.17 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.101 -0.333 . . . . 10.0 110.101 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.474 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.2 mm-40 -78.92 154.54 29.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.66 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -70.51 -14.83 62.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.96 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.5 p -74.43 -25.42 59.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.759 179.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.84 -9.59 44.02 Favored Glycine 0 C--N 1.332 0.328 0 CA-C-N 115.919 -0.582 . . . . 10.0 112.107 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.799 -1.001 . . . . 10.0 110.928 -179.339 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 7.0 t30 . . . . . 0 N--CA 1.483 1.203 0 CA-C-O 121.07 0.462 . . . . 10.0 110.62 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 57.2 t-20 -118.08 124.71 48.74 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 109.052 -0.722 . . . . 10.0 109.052 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -122.98 128.26 49.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.225 0.536 . . . . 10.0 111.554 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 360' ' ' ASP . . . . . 0.436 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 18.5 t0 -122.19 130.2 24.8 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 108.376 -0.972 . . . . 10.0 108.376 178.016 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 361' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 59.9 Cg_endo -109.13 127.56 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.115 0 C-N-CA 121.275 1.317 . . . . 10.0 113.904 -179.128 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 2.0 mt -119.96 136.89 55.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 113.815 -1.539 . . . . 10.0 109.192 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 3.1 t -113.95 135.79 52.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-O 121.659 0.742 . . . . 10.0 109.861 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 3.6 tp -113.09 145.0 19.6 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 114.248 -1.342 . . . . 10.0 111.326 -176.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -110.12 129.12 55.75 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.898 -1.046 . . . . 10.0 111.263 -174.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo . . . . . 0 C--O 1.251 1.14 0 C-N-CA 123.133 2.555 . . . . 10.0 111.976 179.316 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 . . . . . 0 N--CA 1.483 1.219 0 CA-C-O 120.468 0.175 . . . . 10.0 110.588 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 38.1 mm -114.1 116.0 51.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.436 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.2 ttpm? -99.95 106.53 18.34 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.986 0.422 . . . . 10.0 110.451 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 31.2 mt -90.99 150.92 21.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.648 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.5 mtpt -107.16 109.68 21.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.283 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.451 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.4 t -92.6 126.59 45.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 179.223 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 27.3 mm -94.8 112.22 26.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.978 0.418 . . . . 10.0 110.992 -179.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.25 160.66 35.03 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.776 -0.647 . . . . 10.0 112.028 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.9 tp60 -63.08 -32.82 74.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.044 0.387 . . . . 10.0 112.044 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -88.9 25.66 1.74 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.777 0.322 . . . . 10.0 111.52 -179.126 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.6 m 65.66 42.58 3.56 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.251 0.548 . . . . 10.0 111.13 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.6 p -101.82 135.11 43.92 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.276 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -108.49 96.39 6.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.272 0.558 . . . . 10.0 109.495 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.451 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 7.2 mm -79.99 129.67 37.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.682 -0.69 . . . . 10.0 111.261 -178.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -101.32 86.23 2.95 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.624 -0.717 . . . . 10.0 109.654 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.27 117.77 30.47 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.506 -0.478 . . . . 10.0 110.167 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -93.22 104.11 16.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.401 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.4 m -103.54 170.49 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.341 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -123.12 135.72 54.49 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.272 -0.27 . . . . 10.0 110.272 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.55 ' O ' ' HB ' ' A' ' 41' ' ' THR . 62.3 tpp -74.13 76.24 1.76 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.437 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.55 ' HB ' ' O ' ' A' ' 40' ' ' MET . 12.0 t 170.39 -24.86 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.334 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.79 151.95 24.0 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.188 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -74.03 144.27 45.17 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.762 -0.653 . . . . 10.0 110.099 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 58.7 mt -75.0 -4.19 36.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.003 0.43 . . . . 10.0 110.616 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.3 tptt -58.17 -50.86 72.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.627 -0.715 . . . . 10.0 109.549 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.425 ' HG3' HD11 ' B' ' 364' ' ' ILE . 4.0 tppp? -63.21 -39.14 93.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.765 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -62.29 -43.37 98.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.072 -0.513 . . . . 10.0 111.582 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -62.62 -45.39 93.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.29 -0.414 . . . . 10.0 112.082 -179.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -73.52 -35.78 65.63 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.0 -0.28 . . . . 10.0 111.715 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.0 m -64.72 -30.81 71.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.952 0.406 . . . . 10.0 110.807 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -69.14 -36.23 77.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.102 0.477 . . . . 10.0 109.796 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.568 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.3 m -63.5 -37.1 86.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.179 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -63.55 -34.61 78.17 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.399 179.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -69.85 -37.93 76.31 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.573 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -79.88 -18.29 51.04 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.796 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.34 24.62 62.97 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.933 -0.651 . . . . 10.0 112.018 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.417 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 18.3 m -124.93 155.92 69.75 Favored Pre-proline 0 C--N 1.325 -0.46 0 N-CA-C 110.618 -0.142 . . . . 10.0 110.618 -179.339 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -65.18 154.62 72.62 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.553 2.169 . . . . 10.0 111.993 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.568 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 17.2 ttt -67.5 157.91 33.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.853 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 33.5 t30 79.21 4.16 2.29 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.767 0.827 . . . . 10.0 111.656 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -93.29 -20.61 20.24 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.126 0.489 . . . . 10.0 109.994 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 43.2 mt -116.81 137.81 51.94 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.771 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.49 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 20.1 ptt-85 -107.44 132.04 53.62 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.258 179.131 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -95.72 115.56 27.6 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.5 mt -105.52 112.5 25.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.065 0.459 . . . . 10.0 110.717 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -117.86 110.63 18.0 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.343 179.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 61.51 28.62 17.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.464 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.18 -21.43 46.05 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.9 -0.667 . . . . 10.0 113.815 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -99.06 150.96 21.47 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 117.269 0.535 . . . . 10.0 111.192 -178.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.2 ptm85 -87.09 134.68 33.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.157 0.503 . . . . 10.0 110.565 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.9 mm -75.25 125.48 34.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.998 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -85.32 168.79 14.36 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.301 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.81 -25.72 59.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.92 0.39 . . . . 10.0 110.872 -179.462 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -98.08 20.59 12.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.761 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.5 m170 -88.77 156.97 18.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.729 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.484 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 5.0 p -134.78 154.74 79.58 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.83 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -64.85 -15.01 48.21 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.382 2.055 . . . . 10.0 112.119 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -70.1 -40.37 74.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.817 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.4 pt-20 -85.54 167.9 14.99 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.818 -0.438 . . . . 10.0 109.818 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.1 mt 73.06 -53.04 0.71 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.108 0.563 . . . . 10.0 110.754 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.79 81.41 0.86 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.931 -0.652 . . . . 10.0 112.464 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.2 mtt -109.11 132.0 54.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.685 0.279 . . . . 10.0 110.286 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -128.66 -177.11 4.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.555 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.436 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 21.5 tp10 -74.89 137.03 41.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.446 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 68.89 28.19 5.38 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.675 0.609 . . . . 10.0 111.203 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.82 153.94 30.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.005 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 67.2 t -105.53 132.7 51.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.975 0.416 . . . . 10.0 111.744 -178.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.1 tt -136.95 143.36 35.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.088 -0.708 . . . . 10.0 109.088 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -110.69 149.82 29.92 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.951 0.405 . . . . 10.0 111.472 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.6 p -136.91 132.17 47.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.841 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -139.02 165.32 27.45 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.447 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -80.19 135.97 36.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.232 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.49 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.1 mm-40 -78.49 171.07 15.64 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.861 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -89.17 -5.59 57.61 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.108 0.48 . . . . 10.0 109.855 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.0 p -78.07 -67.76 0.7 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.68 -0.691 . . . . 10.0 111.123 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 130.13 -28.79 3.81 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.001 -0.619 . . . . 10.0 111.93 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.69 -1.061 . . . . 10.0 111.538 179.658 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 42.0 t30 . . . . . 0 N--CA 1.483 1.205 0 CA-C-O 120.962 0.41 . . . . 10.0 110.392 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -122.32 121.38 36.6 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.382 -0.97 . . . . 10.0 108.382 177.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -126.25 128.71 47.62 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.9 0.704 . . . . 10.0 112.9 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 360' ' ' ASP . . . . . 0.41 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 28.6 t70 -124.18 129.71 24.63 Favored Pre-proline 0 C--N 1.313 -0.989 0 N-CA-C 106.73 -1.581 . . . . 10.0 106.73 175.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 361' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 43.6 Cg_endo -109.84 127.92 0.04 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 121.843 1.696 . . . . 10.0 113.959 -178.147 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.9 mt -118.95 135.93 57.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 114.739 -1.119 . . . . 10.0 110.112 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 1.4 t -113.29 135.4 52.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.129 -0.487 . . . . 10.0 109.94 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 364' ' ' ILE . . . . . 0.425 HD11 ' HG3' ' A' ' 46' ' ' LYS . 6.1 tp -114.06 144.34 21.86 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 114.964 -1.016 . . . . 10.0 110.929 -177.547 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -110.81 128.96 55.96 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 122.082 0.944 . . . . 10.0 111.378 -175.324 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo . . . . . 0 C--O 1.246 0.898 0 C-N-CA 122.766 2.311 . . . . 10.0 111.479 179.712 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 110.161 -0.311 . . . . 10.0 110.161 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.5 mm -113.86 125.83 71.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.368 -0.378 . . . . 10.0 109.983 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -96.46 105.16 17.2 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.083 0.468 . . . . 10.0 111.213 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 91.3 mt -90.6 140.85 29.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.905 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.2 mtpt -106.53 116.47 31.98 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.933 0.397 . . . . 10.0 111.135 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.509 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.8 t -101.98 123.84 55.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 37.7 mm -97.78 108.52 21.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.063 0.459 . . . . 10.0 110.832 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.29 170.9 54.31 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.678 -0.692 . . . . 10.0 112.014 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -70.63 -19.17 62.84 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.974 0.416 . . . . 10.0 110.898 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -96.38 21.66 8.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.454 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.3 m 61.97 37.47 14.98 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.476 -0.784 . . . . 10.0 111.136 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 p -90.18 138.93 31.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.126 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 2.0 mt-10 -104.7 94.05 5.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.095 0.474 . . . . 10.0 110.051 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.509 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 19.6 mm -80.84 121.64 34.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.027 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -103.01 88.05 3.07 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.518 -0.549 . . . . 10.0 109.518 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -91.01 114.58 27.14 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.405 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.6 ttmt -86.99 97.99 11.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.046 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.487 HG12 HD11 ' A' ' 47' ' ' LEU . 4.0 m -100.72 172.95 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.621 -179.393 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 tttt -124.55 135.6 53.29 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.82 -0.437 . . . . 10.0 109.82 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 56.8 tpp -74.61 78.64 1.99 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.891 0.377 . . . . 10.0 111.313 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 7.0 t 174.67 -32.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.336 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.493 ' OG1' ' HB2' ' B' ' 366' ' ' ASP . 0.2 OUTLIER -78.22 148.43 33.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.888 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -72.16 148.96 45.13 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.407 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 80.1 mt -71.22 -6.51 40.19 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.997 0.427 . . . . 10.0 110.463 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.473 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 42.7 tptt -57.38 -52.86 63.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.752 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.43 ' HZ3' ' P ' ' B' ' 365' ' ' SEP . 5.5 tppp? -60.79 -33.82 73.56 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.221 -0.9 . . . . 10.0 111.072 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.487 HD11 HG12 ' A' ' 38' ' ' VAL . 4.0 mm? -69.63 -44.98 69.54 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.223 -179.382 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 57.1 mtpt -61.13 -47.01 88.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.982 -178.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 6.5 pt-20 -68.06 -43.07 79.48 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.932 -0.307 . . . . 10.0 111.603 -179.074 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.1 m -62.7 -34.28 76.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.702 0.287 . . . . 10.0 111.199 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -66.6 -38.85 87.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.697 0.284 . . . . 10.0 110.291 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.578 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.5 m -63.47 -41.28 98.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 10.0 109.828 179.31 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -64.25 -36.61 84.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.328 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -63.02 -32.08 73.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.847 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -89.63 -31.13 17.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.718 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 106.96 -19.92 34.46 Favored Glycine 0 C--O 1.23 -0.135 0 C-N-CA 121.111 -0.566 . . . . 10.0 112.251 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.414 ' H ' HG22 ' A' ' 57' ' ' VAL . 5.0 m -77.29 155.5 81.93 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 110.543 -0.169 . . . . 10.0 110.543 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -62.11 168.03 9.83 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.479 2.12 . . . . 10.0 111.875 179.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.578 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 24.9 ttt -70.46 148.16 48.63 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.785 0.326 . . . . 10.0 111.45 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t30 73.52 6.78 5.09 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.124 -0.944 . . . . 10.0 112.501 178.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.3 p -76.73 -24.85 53.03 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.852 -0.795 . . . . 10.0 108.852 178.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 56.1 mt -115.15 132.24 56.67 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 114.863 -1.062 . . . . 10.0 109.757 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.54 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 13.2 ptt-85 -100.86 129.98 46.8 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.202 -0.453 . . . . 10.0 110.417 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.472 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 64.9 m-85 -91.42 119.1 31.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.018 179.496 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.8 mt -108.98 121.24 44.7 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.539 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -129.96 111.07 12.18 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.652 -0.703 . . . . 10.0 109.627 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 66.57 23.5 10.36 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.214 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.94 -8.23 70.32 Favored Glycine 0 N--CA 1.453 -0.195 0 C-N-CA 121.014 -0.612 . . . . 10.0 113.1 179.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -109.33 144.14 37.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.587 0.232 . . . . 10.0 110.668 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.472 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 11.9 ptm180 -84.01 133.83 34.66 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.173 0.511 . . . . 10.0 110.438 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.1 mm -71.68 125.02 29.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.878 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.02 167.22 19.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.09 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.39 -25.25 59.37 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.162 0.506 . . . . 10.0 110.719 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -96.13 13.74 26.24 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.791 -0.64 . . . . 10.0 111.073 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.9 m170 -85.35 152.52 23.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.149 0.5 . . . . 10.0 111.223 -179.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.515 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 35.4 p -124.43 155.58 68.58 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.95 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -70.94 -10.78 28.27 Favored 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.166 1.911 . . . . 10.0 112.19 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -77.76 -30.1 51.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.386 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.2 pt-20 -92.81 174.69 7.12 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.583 -0.525 . . . . 10.0 109.583 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 4.8 mt 72.89 -56.59 0.66 Allowed 'General case' 0 N--CA 1.469 0.503 0 O-C-N 123.548 0.53 . . . . 10.0 111.017 -179.46 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 126.16 66.12 0.17 Allowed Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 121.206 -0.521 . . . . 10.0 111.917 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 55.7 mtt -101.85 134.21 45.39 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.738 0.304 . . . . 10.0 110.367 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 0.3 OUTLIER -138.65 178.61 7.02 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.766 -179.848 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.429 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 13.4 tp10 -67.02 143.71 56.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.265 -0.425 . . . . 10.0 109.944 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 22.4 mm-40 70.4 22.24 5.36 Favored 'General case' 0 C--O 1.232 0.169 0 O-C-N 123.716 0.635 . . . . 10.0 111.732 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.3 OUTLIER -78.89 153.23 30.68 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.352 179.433 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 89.6 t -115.77 128.45 73.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.441 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.9 tt -124.49 144.61 33.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.434 -0.58 . . . . 10.0 109.434 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -105.38 144.84 31.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.849 0.357 . . . . 10.0 110.893 -178.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 9.8 p -135.81 129.86 48.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.987 0.422 . . . . 10.0 110.226 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -135.54 167.69 20.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.508 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -83.18 134.1 34.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.714 0.293 . . . . 10.0 111.145 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.54 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 3.0 mm-40 -74.14 152.42 39.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.396 179.491 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -70.3 -17.16 63.08 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.774 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.2 p -77.08 -25.12 51.97 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.191 0.519 . . . . 10.0 110.639 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.25 -3.81 86.59 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.933 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.822 -0.988 . . . . 10.0 111.295 -179.732 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 65.9 t30 . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 121.014 0.435 . . . . 10.0 110.595 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 358' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 54.1 t30 -121.77 122.24 39.05 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.532 -0.914 . . . . 10.0 108.532 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 359' ' ' ARG . . . . . 0.481 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 23.2 ptt180 -126.0 128.7 47.87 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 119.791 -0.764 . . . . 10.0 112.035 179.258 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 360' ' ' ASP . . . . . 0.406 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 28.2 t70 -120.8 130.87 24.65 Favored Pre-proline 0 C--N 1.316 -0.864 0 N-CA-C 106.8 -1.556 . . . . 10.0 106.8 177.407 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 361' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 58.4 Cg_endo -108.07 128.61 0.05 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.524 0 C-N-CA 121.481 1.454 . . . . 10.0 113.179 -178.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.2 mt -119.27 136.99 54.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 114.128 -1.396 . . . . 10.0 109.734 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 48.7 t -113.25 135.21 53.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.269 0.557 . . . . 10.0 109.59 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 7.1 tp -112.96 144.01 21.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 114.854 -1.067 . . . . 10.0 110.594 -177.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 365' ' ' SEP . . . . . 0.43 ' P ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 366' ' ' ASP . . . . . 0.493 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 1.1 t70 -113.28 129.19 56.59 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.396 -1.274 . . . . 10.0 110.568 -176.346 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo . . . . . 0 C--O 1.246 0.891 0 C-N-CA 122.598 2.198 . . . . 10.0 111.396 179.77 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.5 mm -113.02 124.43 69.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 110.002 -0.37 . . . . 10.0 110.002 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.403 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 2.8 ttpm? -102.38 112.98 25.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.032 0.444 . . . . 10.0 110.385 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.1 mt -98.07 135.49 39.68 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.307 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -95.34 113.45 25.12 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.671 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.537 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.5 t -96.41 128.42 47.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.745 -0.662 . . . . 10.0 109.584 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.3 mm -101.54 109.49 25.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 120.838 0.352 . . . . 10.0 110.747 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -76.74 174.09 54.27 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 121.027 -0.606 . . . . 10.0 112.626 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 13.8 tp60 -69.92 -29.91 67.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.81 0.338 . . . . 10.0 111.662 -179.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -104.96 40.6 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.062 0.458 . . . . 10.0 111.17 -179.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.7 m 57.9 36.0 25.87 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.692 -0.686 . . . . 10.0 111.328 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.65 94.42 9.85 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.691 -0.686 . . . . 10.0 109.929 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.644 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 20.6 mt-10 -78.64 104.9 9.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.086 0.47 . . . . 10.0 109.784 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.1 mm -95.57 136.79 25.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.28 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 45.9 m-70 -110.97 95.33 5.48 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.512 -0.551 . . . . 10.0 109.512 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.04 121.28 34.22 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.356 -0.383 . . . . 10.0 110.499 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -89.17 107.4 19.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.809 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.407 HG12 HD11 ' A' ' 47' ' ' LEU . 4.4 m -110.27 171.05 3.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.969 0.414 . . . . 10.0 110.94 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 75.4 tttt -122.33 140.56 52.52 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.538 ' O ' ' HB ' ' A' ' 41' ' ' THR . 51.6 tpp -74.94 74.9 2.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.745 0.307 . . . . 10.0 111.449 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.538 ' HB ' ' O ' ' A' ' 40' ' ' MET . 14.5 t 169.82 -24.91 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.559 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -75.99 149.6 37.58 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.887 0.375 . . . . 10.0 110.934 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 25.4 m170 -78.36 138.31 38.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.003 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.1 mt -65.69 -16.17 63.5 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.528 -0.305 . . . . 10.0 111.46 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.44 ' HD2' ' HB3' ' A' ' 73' ' ' ASP . 34.7 tttp -60.31 -42.9 96.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.012 0.434 . . . . 10.0 109.91 178.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -65.58 -30.72 71.49 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.034 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.407 HD11 HG12 ' A' ' 38' ' ' VAL . 4.4 mm? -74.56 -49.13 23.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.626 -0.715 . . . . 10.0 111.094 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -56.61 -46.8 80.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.567 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -65.21 -40.37 94.05 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.282 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 65.9 m -67.41 -34.66 77.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.311 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -63.37 -40.84 98.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.995 0.426 . . . . 10.0 109.869 179.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 39.0 m -62.73 -42.21 99.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.767 179.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -64.76 -30.41 71.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.646 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -72.52 -45.15 60.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.033 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -76.56 -14.12 60.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.409 -0.36 . . . . 10.0 111.01 -179.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.71 37.17 17.41 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.864 -0.684 . . . . 10.0 112.178 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.6 m -130.42 155.4 81.08 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-O 120.511 0.196 . . . . 10.0 110.547 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -66.22 163.95 29.82 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 122.176 1.917 . . . . 10.0 111.92 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 12.1 tpt -70.62 150.68 45.78 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 110.065 -0.346 . . . . 10.0 110.065 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.0 t30 73.75 5.99 4.9 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.105 0.562 . . . . 10.0 112.166 179.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 80.4 p -84.0 -23.29 31.05 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.145 0.497 . . . . 10.0 110.351 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 43.7 mt -121.21 147.21 45.92 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.428 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.441 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 18.0 ptt-85 -116.9 134.24 55.01 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.243 -0.435 . . . . 10.0 109.963 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.415 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 86.0 m-85 -95.9 128.29 42.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.091 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 90.7 mt -112.23 125.89 54.64 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.229 0.538 . . . . 10.0 111.369 -179.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -137.59 118.51 14.25 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.537 -0.912 . . . . 10.0 108.537 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 66.23 19.6 11.07 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.218 0.532 . . . . 10.0 110.494 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.16 -4.84 84.61 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.221 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -105.39 145.46 30.77 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.189 -0.3 . . . . 10.0 110.189 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.415 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 12.1 ptm180 -85.0 125.76 32.98 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.089 0.471 . . . . 10.0 110.214 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 43.6 mm -63.98 123.58 17.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.313 -0.858 . . . . 10.0 111.52 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.07 166.22 15.19 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.203 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.44 ' HB3' ' HD2' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -73.89 -19.15 60.79 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.995 0.426 . . . . 10.0 111.378 -179.389 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -97.06 17.22 17.53 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.117 -0.492 . . . . 10.0 111.045 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -99.94 153.03 19.5 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.051 0.453 . . . . 10.0 111.129 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.424 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 57.5 p -131.63 162.82 53.9 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 108.961 -0.755 . . . . 10.0 108.961 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -69.99 -5.91 17.47 Favored 'Trans proline' 0 CA--C 1.53 0.317 0 C-N-CA 122.33 2.02 . . . . 10.0 112.16 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.64 -30.38 61.61 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.683 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.49 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 1.4 pt-20 -101.38 171.56 7.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.162 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 7.5 mt 73.26 -49.0 0.69 Allowed 'General case' 0 N--CA 1.469 0.498 0 O-C-N 123.699 0.624 . . . . 10.0 111.285 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 113.53 76.27 0.73 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.83 -0.7 . . . . 10.0 112.443 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 58.1 mtt -105.76 122.46 46.12 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.837 0.351 . . . . 10.0 110.265 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.533 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 5.4 mm-40 -120.97 -178.75 3.82 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.949 -179.269 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.403 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 15.9 tp10 -70.74 144.03 51.06 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 179.133 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 67.04 23.54 9.7 Favored 'General case' 0 N--CA 1.462 0.171 0 O-C-N 123.523 0.514 . . . . 10.0 110.904 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.533 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.8 OUTLIER -75.6 148.51 38.75 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.862 -0.421 . . . . 10.0 109.862 179.788 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 94.8 t -107.13 119.57 56.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.038 0.447 . . . . 10.0 111.446 -178.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.537 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 15.6 tt -118.49 136.36 55.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -103.07 150.65 23.39 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.84 0.352 . . . . 10.0 110.975 -178.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.6 p -136.43 131.43 48.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.012 179.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -135.02 159.87 40.14 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.411 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -73.49 136.92 44.2 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.505 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.441 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 1.3 mm-40 -73.5 159.62 32.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.697 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -72.98 -24.79 60.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.191 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.8 p -78.28 -34.27 49.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.214 0.53 . . . . 10.0 110.899 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.31 12.92 77.84 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.925 -0.87 . . . . 10.0 110.925 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.947 0 CA-C-O 118.876 -0.958 . . . . 10.0 111.283 -179.642 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 . . . . . 0 N--CA 1.48 1.025 0 CA-C-O 121.347 0.594 . . . . 10.0 110.168 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 358' ' ' ASN . . . . . 0.644 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 2.5 m-20 -120.17 125.88 49.3 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 108.454 -0.943 . . . . 10.0 108.454 179.035 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 22.3 ptt180 -125.84 122.05 35.02 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 119.378 -0.929 . . . . 10.0 113.019 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -128.46 127.27 23.64 Favored Pre-proline 0 C--N 1.316 -0.888 0 N-CA-C 107.536 -1.283 . . . . 10.0 107.536 174.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -110.78 126.34 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.154 0 C-N-CA 121.66 1.573 . . . . 10.0 113.086 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.7 mt -120.27 135.56 60.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.027 -0.988 . . . . 10.0 109.707 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 21.6 t -113.19 135.74 51.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.47 0.652 . . . . 10.0 109.721 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 364' ' ' ILE . . . . . 0.426 HD12 ' HA ' ' B' ' 364' ' ' ILE . 7.8 tp -113.27 147.9 16.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 114.836 -1.075 . . . . 10.0 112.107 -176.135 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -113.7 131.92 55.99 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.301 -0.863 . . . . 10.0 112.367 -174.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_endo . . . . . 0 C--O 1.248 1.011 0 C-N-CA 123.132 2.554 . . . . 10.0 112.293 179.547 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 . . . . . 0 N--CA 1.478 0.95 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.418 ' O ' HG22 ' A' ' 38' ' ' VAL . 39.1 mm -118.55 113.4 41.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.762 -0.459 . . . . 10.0 109.762 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.418 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 2.6 ttpm? -96.7 111.61 23.7 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.236 -0.438 . . . . 10.0 109.9 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 30.1 mt -94.03 150.87 19.95 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.4 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 38.0 mtpt -110.31 107.53 17.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.284 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.488 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 3.2 t -89.08 126.21 42.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.598 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.9 mm -93.54 115.87 33.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 120.984 0.421 . . . . 10.0 111.188 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.59 147.1 19.75 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 111.256 -0.738 . . . . 10.0 111.256 178.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -64.47 -21.14 66.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.778 0.323 . . . . 10.0 111.811 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -95.45 28.21 3.03 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 120.857 0.36 . . . . 10.0 111.021 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.1 m 61.0 66.42 0.9 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.588 0.708 . . . . 10.0 110.919 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.2 p -136.59 144.85 44.34 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.096 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -118.57 103.86 10.12 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.488 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 5.5 mm -88.77 119.74 36.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.197 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -96.93 96.53 8.58 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -97.3 112.86 24.49 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.398 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -86.73 103.13 14.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.977 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.418 HG22 ' O ' ' A' ' 22' ' ' ILE . 2.9 m -108.31 173.13 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.816 0.341 . . . . 10.0 110.675 -179.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.433 ' HD2' ' CG2' ' A' ' 41' ' ' THR . 23.4 ttmt -121.9 137.79 54.65 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.298 -0.63 . . . . 10.0 109.298 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.45 ' O ' ' HB ' ' A' ' 41' ' ' THR . 61.9 tpp -73.94 78.9 1.65 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.957 0.408 . . . . 10.0 110.598 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.45 ' HB ' ' O ' ' A' ' 40' ' ' MET . 15.3 t 174.09 -26.33 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.444 -0.798 . . . . 10.0 110.081 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.31 151.88 26.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.417 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.415 ' ND1' ' HB3' ' A' ' 45' ' ' LYS . 6.3 p80 -76.87 145.55 38.26 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.097 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.5 mt -71.83 -8.97 57.47 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.588 -0.278 . . . . 10.0 111.285 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.415 ' HB3' ' ND1' ' A' ' 43' ' ' HIS . 47.3 tptt -59.47 -48.2 82.57 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.061 0.458 . . . . 10.0 110.007 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.574 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.4 tppp? -62.85 -33.94 76.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.309 -0.859 . . . . 10.0 110.715 179.635 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.414 HD11 HG12 ' A' ' 38' ' ' VAL . 3.1 mm? -71.98 -44.24 63.83 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.286 -179.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -61.63 -42.6 99.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.297 -0.41 . . . . 10.0 111.399 -179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -72.34 -39.83 67.84 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 121.001 -0.28 . . . . 10.0 111.289 -179.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.437 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 66.4 m -63.45 -35.77 81.53 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.75 0.31 . . . . 10.0 111.411 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -64.32 -41.46 96.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.799 0.333 . . . . 10.0 110.177 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 57.2 m -62.3 -38.23 88.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.348 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.437 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.4 mt-30 -65.9 -42.9 89.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.79 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -61.75 -35.67 78.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.417 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -83.22 -16.82 45.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.849 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.31 35.58 42.25 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.094 -0.574 . . . . 10.0 112.535 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.3 m -131.37 155.55 81.34 Favored Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 110.24 -0.282 . . . . 10.0 110.24 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.34 159.57 39.18 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.358 2.039 . . . . 10.0 111.769 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 16.0 ttt -71.01 155.95 40.21 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 121.225 -0.19 . . . . 10.0 110.702 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 32.8 t30 76.65 -7.38 1.85 Allowed 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.542 0.737 . . . . 10.0 111.981 179.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.5 p -75.79 -19.45 58.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.226 0.536 . . . . 10.0 110.276 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.3 mt -116.97 135.27 53.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.253 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.433 ' HD3' ' OE2' ' A' ' 93' ' ' GLU . 7.1 ptt180 -111.34 119.96 40.61 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.145 0.498 . . . . 10.0 110.432 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -88.22 124.92 34.33 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.889 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 34.2 mt -114.5 124.86 52.97 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.044 0.449 . . . . 10.0 110.974 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -135.17 119.88 18.3 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.281 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 64.78 20.57 12.17 Favored 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.433 0.458 . . . . 10.0 111.136 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.71 2.45 81.75 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.912 -0.661 . . . . 10.0 112.302 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -114.76 145.06 42.52 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.749 -0.463 . . . . 10.0 109.749 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -80.98 142.19 33.69 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.975 0.417 . . . . 10.0 109.901 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.2 mm -79.28 121.17 31.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.427 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.7 169.47 18.18 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.505 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -81.71 -18.27 44.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.808 0.337 . . . . 10.0 111.085 -179.06 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -101.86 0.96 36.44 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.781 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 18.4 m170 -71.53 159.13 35.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.936 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.6 p -134.57 160.71 67.42 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.826 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -67.12 -14.66 44.15 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.454 2.103 . . . . 10.0 112.249 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -69.28 -46.41 67.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.527 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -82.79 172.91 12.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.147 -0.478 . . . . 10.0 109.839 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.0 mt 73.45 -46.56 0.64 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.164 0.586 . . . . 10.0 111.047 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 110.9 63.48 0.5 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 121.185 -0.531 . . . . 10.0 112.68 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 43.5 mtt -101.68 128.45 47.99 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.844 0.354 . . . . 10.0 110.711 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 2.8 mm-40 -132.56 -174.39 3.44 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.63 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.418 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 42.5 tp10 -66.28 138.33 57.57 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.183 -179.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 66.27 26.3 10.39 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 123.727 0.642 . . . . 10.0 111.9 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.4 OUTLIER -76.3 141.52 41.59 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.851 -0.426 . . . . 10.0 109.851 179.04 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 59.6 t -96.36 120.26 45.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.504 -178.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 15.3 tt -128.8 138.16 55.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.646 -0.707 . . . . 10.0 109.193 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -112.74 149.7 32.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.97 0.414 . . . . 10.0 111.462 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.4 p -130.96 133.86 62.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.184 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -124.84 168.77 12.79 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.985 -0.552 . . . . 10.0 109.577 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -83.08 138.76 33.57 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.362 -0.607 . . . . 10.0 109.362 178.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.433 ' OE2' ' HD3' ' A' ' 63' ' ' ARG . 2.8 mm-40 -74.67 170.41 15.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.197 0.522 . . . . 10.0 111.139 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -82.87 -28.87 29.75 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.483 -0.78 . . . . 10.0 109.687 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -74.35 -55.15 6.33 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.603 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 104.4 11.87 30.26 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.608 -0.806 . . . . 10.0 112.835 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.794 0 CA-C-O 118.891 -0.949 . . . . 10.0 111.913 179.548 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 121.22 0.534 . . . . 10.0 110.869 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 63.0 t-20 -121.16 124.09 43.88 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.458 -0.571 . . . . 10.0 109.458 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 33.2 ptt180 -123.3 126.08 46.24 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.286 0.565 . . . . 10.0 112.507 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -125.33 128.68 24.68 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 108.263 -1.014 . . . . 10.0 108.263 176.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -111.02 128.0 0.03 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 121.851 1.7 . . . . 10.0 113.52 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 6.1 mt -120.51 137.26 54.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 114.807 -1.088 . . . . 10.0 109.965 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 37.7 t -112.54 134.57 54.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.309 -0.626 . . . . 10.0 109.309 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 364' ' ' ILE . . . . . 0.574 HD11 ' HG3' ' A' ' 46' ' ' LYS . 7.6 tp -113.91 145.42 19.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 114.809 -1.087 . . . . 10.0 111.514 -176.113 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.95 129.91 56.02 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 114.954 -1.021 . . . . 10.0 111.204 -175.144 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo . . . . . 0 C--O 1.246 0.883 0 C-N-CA 122.809 2.34 . . . . 10.0 112.404 179.679 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 N--CA 1.475 0.822 0 CA-C-O 120.782 0.325 . . . . 10.0 110.436 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 18.1 mm -106.3 123.18 60.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.499 -0.556 . . . . 10.0 109.499 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.478 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 4.5 ttpm? -96.47 108.12 20.63 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.183 0.516 . . . . 10.0 110.691 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.8 mt -93.36 137.37 32.73 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.844 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -99.87 106.97 18.86 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.116 0.484 . . . . 10.0 110.819 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.0 t -89.41 130.15 39.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.293 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 41.7 mm -91.01 111.59 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.905 0.383 . . . . 10.0 110.779 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -77.37 157.86 46.8 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.689 -0.687 . . . . 10.0 112.235 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 12.6 tp60 -58.52 -32.24 68.65 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -97.07 29.16 3.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.775 0.321 . . . . 10.0 111.387 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 m 64.52 35.4 9.38 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.351 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.23 136.98 32.72 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.725 -0.67 . . . . 10.0 110.101 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -100.16 101.04 11.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.891 0.376 . . . . 10.0 110.344 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -88.61 120.61 37.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.268 -0.423 . . . . 10.0 109.94 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -100.18 98.62 9.3 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -99.98 118.63 36.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.143 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.4 ttmt -91.9 103.49 16.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.241 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 5.0 m -100.2 171.36 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.24 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -121.53 141.73 50.77 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.225 -0.443 . . . . 10.0 109.976 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.411 ' O ' ' HB ' ' A' ' 41' ' ' THR . 57.8 tpp -81.08 73.05 8.13 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.016 0.436 . . . . 10.0 111.032 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.411 ' HB ' ' O ' ' A' ' 40' ' ' MET . 8.9 t 175.95 -26.16 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.192 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.57 147.36 25.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.254 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 29.8 m80 -75.52 148.8 38.67 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.242 -0.281 . . . . 10.0 110.242 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.514 ' HA ' HD23 ' A' ' 47' ' ' LEU . 35.7 mt -67.66 -10.53 53.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.813 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.552 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 51.2 tptt -57.77 -43.85 85.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.766 -0.652 . . . . 10.0 109.738 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -67.4 -32.21 72.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.395 -0.821 . . . . 10.0 110.956 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.514 HD23 ' HA ' ' A' ' 44' ' ' LEU . 2.7 mm? -74.05 -42.92 59.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.542 -178.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -59.76 -48.37 81.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.939 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 20.0 pt-20 -67.7 -37.81 82.77 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.864 0.32 . . . . 10.0 111.864 -178.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.6 m -68.34 -32.6 72.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.695 0.283 . . . . 10.0 111.463 -179.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 50.1 t80 -66.87 -39.05 87.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.893 0.377 . . . . 10.0 110.224 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.528 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 81.2 m -62.17 -36.72 82.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.41 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -65.14 -35.96 82.76 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.121 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -64.8 -36.16 83.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.69 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -92.24 -6.92 49.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.394 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 69.58 36.81 77.08 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.917 -0.658 . . . . 10.0 112.43 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.512 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 17.6 m -126.0 155.21 73.59 Favored Pre-proline 0 C--N 1.323 -0.583 0 N-CA-C 110.133 -0.321 . . . . 10.0 110.133 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -68.85 157.85 60.2 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.126 1.884 . . . . 10.0 111.588 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.528 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 9.4 ttt -69.72 154.74 41.56 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.036 -0.265 . . . . 10.0 110.344 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.3 t30 77.35 -3.59 2.43 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 123.939 0.775 . . . . 10.0 111.575 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 87.5 p -83.84 -19.0 35.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.204 0.526 . . . . 10.0 109.71 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 82.6 mt -117.02 126.13 52.41 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.268 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.465 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.8 ptt-85 -100.0 121.86 42.02 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.095 0.474 . . . . 10.0 109.858 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -89.99 111.9 23.13 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.8 mt -99.61 113.3 25.64 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.227 -178.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -113.82 101.61 9.45 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.375 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 60.57 38.37 18.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.026 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.07 -34.0 4.79 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.852 -0.613 . . . . 10.0 113.045 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -83.7 135.04 34.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.716 0.294 . . . . 10.0 110.819 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -83.46 131.81 35.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.979 0.419 . . . . 10.0 110.416 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 48.3 mm -68.27 120.64 16.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.824 -0.625 . . . . 10.0 111.583 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.14 177.67 8.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.278 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.552 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 0.8 OUTLIER -83.86 -14.02 52.22 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.552 -0.294 . . . . 10.0 111.504 -179.074 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.4 p-10 -108.89 9.88 26.57 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.679 -0.237 . . . . 10.0 111.391 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.4 ' HB3' HD12 ' A' ' 44' ' ' LEU . 3.1 m170 -78.56 157.36 28.81 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.957 0.408 . . . . 10.0 111.265 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.541 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.8 OUTLIER -136.54 154.0 76.46 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.64 179.521 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -66.42 -11.0 29.71 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.741 2.294 . . . . 10.0 112.745 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -74.62 -24.34 58.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.32 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.541 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.5 pt-20 -107.18 -179.01 3.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.123 -0.49 . . . . 10.0 109.713 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.44 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 6.1 mt 71.21 -62.76 0.44 Allowed 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.762 0.664 . . . . 10.0 111.113 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 130.59 59.89 0.1 OUTLIER Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 111.654 -0.578 . . . . 10.0 111.654 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 53.6 mtt -97.38 125.93 42.31 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.75 0.31 . . . . 10.0 110.827 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.441 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.6 mm-40 -127.64 -175.39 3.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.878 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.478 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 15.3 tp10 -71.38 138.11 48.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.445 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 64.64 34.34 9.87 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 123.565 0.54 . . . . 10.0 110.723 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.0 OUTLIER -79.53 147.69 32.07 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.24 179.683 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.4 t -103.17 124.64 57.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.987 0.423 . . . . 10.0 111.585 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.4 tt -131.95 147.15 32.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.985 -0.552 . . . . 10.0 109.723 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -107.41 151.55 25.38 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.871 0.367 . . . . 10.0 111.381 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.8 p -135.83 125.83 41.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.887 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -133.18 160.59 36.79 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.73 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.78 133.79 35.14 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.398 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.465 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.9 mm-40 -76.47 150.61 36.65 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.724 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -68.14 -21.68 64.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.939 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.8 p -76.97 -15.05 59.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.949 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.29 5.32 66.42 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 121.105 -0.569 . . . . 10.0 112.296 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.876 0 CA-C-O 118.719 -1.045 . . . . 10.0 111.097 -179.426 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 54.7 t30 . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.655 0.264 . . . . 10.0 111.28 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -122.03 120.03 33.16 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.04 -1.096 . . . . 10.0 108.04 177.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -129.59 129.79 44.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.179 0.514 . . . . 10.0 112.131 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 360' ' ' ASP . . . . . 0.42 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 27.1 t0 -121.59 128.09 25.78 Favored Pre-proline 0 C--N 1.308 -1.218 0 N-CA-C 107.06 -1.459 . . . . 10.0 107.06 175.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 361' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 77.7 Cg_endo -108.86 128.48 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 121.89 1.726 . . . . 10.0 113.695 -178.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.3 mt -120.64 134.6 63.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 114.549 -1.205 . . . . 10.0 110.171 179.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 6.0 t -115.08 135.61 54.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 109.08 -0.711 . . . . 10.0 109.08 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 364' ' ' ILE . . . . . 0.44 HD12 ' HA ' ' B' ' 364' ' ' ILE . 7.2 tp -114.57 146.06 19.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.503 -0.771 . . . . 10.0 112.423 -176.503 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -111.2 131.67 54.94 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.468 -0.787 . . . . 10.0 112.529 -174.346 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 367' ' ' SEP . . . . . 0.459 ' HA ' ' HD3' ' B' ' 368' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 368' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' B' ' 367' ' ' SEP . 25.0 Cg_exo . . . . . 0 C--O 1.247 0.948 0 C-N-CA 122.916 2.411 . . . . 10.0 111.729 178.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 110.063 -0.347 . . . . 10.0 110.063 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.2 mm -111.49 113.23 43.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.325 -0.398 . . . . 10.0 109.962 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.516 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.9 OUTLIER -96.05 109.48 21.89 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.312 0.577 . . . . 10.0 110.282 179.629 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 67.1 mt -95.67 144.01 26.45 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.039 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.5 mtpt -104.43 109.67 21.63 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.896 0.379 . . . . 10.0 110.548 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.454 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.3 t -90.37 128.9 41.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.93 -0.577 . . . . 10.0 109.517 179.285 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.5 mm -87.98 109.49 19.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.369 -0.378 . . . . 10.0 111.349 -179.408 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.01 160.29 40.55 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.79 -0.719 . . . . 10.0 111.365 178.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -62.72 -35.84 81.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.89 0.345 . . . . 10.0 111.47 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 17.0 p-10 -88.88 27.94 1.25 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.935 0.397 . . . . 10.0 111.235 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.9 m 61.38 30.54 19.03 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.575 -0.739 . . . . 10.0 111.442 179.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.3 p -82.49 133.31 35.2 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.524 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.527 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 37.0 mt-10 -95.82 96.34 8.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.175 0.512 . . . . 10.0 110.231 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.454 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 2.1 mm -85.68 115.91 27.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.294 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.3 m170 -95.69 96.99 9.37 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.796 -0.446 . . . . 10.0 109.796 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.47 114.46 26.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.641 -179.396 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -91.25 105.87 18.1 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.195 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.9 m -111.41 170.5 3.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.684 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -117.21 149.31 40.62 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.877 -0.416 . . . . 10.0 109.877 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 60.4 tpp -78.27 69.64 4.51 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.557 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.506 HG22 ' OD2' ' B' ' 366' ' ' ASP . 0.4 OUTLIER 173.87 -29.85 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.587 179.189 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.8 137.64 52.01 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.0 m80 -70.84 138.51 50.34 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.093 -0.503 . . . . 10.0 109.889 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.9 mt -66.8 -7.63 22.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.495 -0.32 . . . . 10.0 111.758 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -57.94 -49.63 76.11 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.412 ' HZ3' ' P ' ' B' ' 367' ' ' SEP . 30.6 ttpt -70.3 -34.24 72.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.44 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.429 ' HA ' HD13 ' A' ' 47' ' ' LEU . 2.3 mm? -65.17 -44.65 87.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.86 0.362 . . . . 10.0 110.836 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -60.26 -44.63 95.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.967 -0.56 . . . . 10.0 111.66 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.484 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 17.9 pt-20 -74.53 -34.99 63.13 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.697 -0.401 . . . . 10.0 111.221 -179.403 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.52 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 67.6 m -60.25 -37.36 80.17 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-O 121.072 0.463 . . . . 10.0 110.347 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -64.3 -40.83 96.72 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.562 -0.533 . . . . 10.0 109.562 178.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.414 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 56.7 m -63.93 -39.23 93.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.477 -0.783 . . . . 10.0 110.079 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.52 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 60.4 mt-30 -66.06 -36.06 82.2 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.046 179.319 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -67.64 -37.77 82.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.672 -0.694 . . . . 10.0 110.774 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -80.79 -29.5 36.09 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.999 0.428 . . . . 10.0 110.797 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 96.26 31.06 7.41 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.831 -0.7 . . . . 10.0 112.242 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.414 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 10.9 m -129.8 155.62 80.18 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 110.182 -0.303 . . . . 10.0 110.182 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -67.25 157.74 60.31 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.375 2.05 . . . . 10.0 111.511 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.403 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 10.6 ttt -67.0 156.4 36.1 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.892 -0.323 . . . . 10.0 111.116 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.3 t30 79.06 -8.5 1.63 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.876 0.87 . . . . 10.0 111.953 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 82.8 p -75.75 -23.7 56.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.244 0.545 . . . . 10.0 109.949 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 50.2 mt -116.0 141.33 48.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.482 -0.781 . . . . 10.0 109.981 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' A' ' 63' ' ' ARG . 12.7 ptt180 -113.13 129.19 56.59 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.988 0.423 . . . . 10.0 110.11 179.153 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -95.99 124.79 40.14 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.825 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.1 mt -115.29 126.16 54.15 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.159 0.505 . . . . 10.0 110.926 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -124.88 100.35 6.56 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.246 -0.888 . . . . 10.0 109.058 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 64.98 33.82 9.43 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.066 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.24 -14.42 62.38 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 115.725 -0.671 . . . . 10.0 113.24 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -97.02 136.0 38.21 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.833 -0.432 . . . . 10.0 109.833 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -83.86 140.03 32.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.096 0.474 . . . . 10.0 110.66 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 50.0 mm -77.35 118.3 23.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.728 -0.669 . . . . 10.0 111.083 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.57 160.32 21.45 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.51 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -64.84 -25.84 68.08 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.378 -0.374 . . . . 10.0 111.5 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -95.59 7.12 47.18 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.431 -0.35 . . . . 10.0 111.659 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 3.6 m170 -78.3 150.26 33.35 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.221 0.534 . . . . 10.0 111.412 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.59 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -132.34 148.66 70.59 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.578 -0.737 . . . . 10.0 110.101 179.254 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -60.38 -17.23 46.16 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.695 2.263 . . . . 10.0 112.569 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -67.01 -33.89 76.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.778 -0.647 . . . . 10.0 110.474 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.59 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.4 pt-20 -96.8 173.77 7.14 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.316 -0.402 . . . . 10.0 109.918 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.433 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 87.6 mt 72.34 -59.15 0.57 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.456 0.703 . . . . 10.0 110.512 -178.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 120.78 87.07 0.95 Allowed Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 121.211 -0.518 . . . . 10.0 111.96 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 62.4 mtt -117.61 132.73 56.46 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.611 0.243 . . . . 10.0 110.415 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -126.67 179.2 5.46 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.817 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.516 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 17.2 tp10 -69.89 137.18 51.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.071 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.468 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 5.4 mm-40 71.93 20.38 4.45 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 123.748 0.655 . . . . 10.0 111.591 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.13 147.17 38.73 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.887 -0.325 . . . . 10.0 110.278 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.9 t -99.02 133.71 40.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.88 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.7 tt -134.99 144.13 35.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 178.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -105.92 155.19 19.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.135 0.493 . . . . 10.0 111.997 -178.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.9 p -139.87 127.19 24.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.458 -0.792 . . . . 10.0 109.326 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -133.64 157.89 44.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.606 -0.27 . . . . 10.0 110.391 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -74.6 133.75 42.16 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.14 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.497 ' OE1' ' HA ' ' A' ' 93' ' ' GLU . 3.9 mm-40 -75.69 155.08 36.05 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.754 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -71.78 -24.99 61.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.46 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.2 p -66.92 -39.25 87.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.149 0.499 . . . . 10.0 110.498 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.44 0.9 75.58 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.768 -0.73 . . . . 10.0 112.195 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.825 -0.986 . . . . 10.0 111.295 -179.983 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 121.2 0.524 . . . . 10.0 110.864 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 358' ' ' ASN . . . . . 0.527 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 52.3 t30 -116.74 124.39 49.51 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 108.904 -0.776 . . . . 10.0 108.904 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 359' ' ' ARG . . . . . 0.405 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 16.5 ptt180 -124.69 128.26 48.55 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.45 0.643 . . . . 10.0 111.277 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -120.51 130.37 24.88 Favored Pre-proline 0 C--N 1.314 -0.936 0 N-CA-C 106.631 -1.618 . . . . 10.0 106.631 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -108.23 129.26 0.05 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.331 0 C-N-CA 121.728 1.618 . . . . 10.0 113.317 -178.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.8 mt -116.39 131.8 67.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.379 -1.282 . . . . 10.0 109.352 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 25.9 t -114.96 131.55 66.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.675 0.75 . . . . 10.0 109.43 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 364' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' B' ' 364' ' ' ILE . 7.0 tp -115.49 145.34 21.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-N 114.126 -1.397 . . . . 10.0 110.683 -177.455 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 366' ' ' ASP . . . . . 0.506 ' OD2' HG22 ' A' ' 41' ' ' THR . 11.5 t70 -108.23 129.16 55.21 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.827 0.822 . . . . 10.0 111.258 -174.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 367' ' ' SEP . . . . . 0.412 ' P ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 368' ' ' PRO . . . . . 0.419 ' HD3' ' O ' ' B' ' 366' ' ' ASP . 14.8 Cg_exo . . . . . 0 C--O 1.247 0.928 0 C-N-CA 122.153 1.902 . . . . 10.0 110.992 178.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 . . . . . 0 N--CA 1.478 0.933 0 N-CA-C 110.111 -0.329 . . . . 10.0 110.111 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.8 mm -96.08 113.78 31.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 109.78 -0.452 . . . . 10.0 109.78 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -98.2 115.22 27.89 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.737 0.303 . . . . 10.0 110.497 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 31.1 mt -100.92 145.51 28.55 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.526 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.437 ' HG2' ' CD2' ' A' ' 35' ' ' HIS . 42.0 mtpt -106.58 102.77 12.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.475 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.41 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.9 t -87.37 130.67 36.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 109.541 -0.54 . . . . 10.0 109.541 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.8 mm -102.41 114.61 42.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.893 0.378 . . . . 10.0 110.438 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.17 175.38 54.65 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.801 -0.636 . . . . 10.0 112.705 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.7 tp60 -61.42 -29.5 69.98 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 122.57 0.348 . . . . 10.0 111.66 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -97.64 18.97 14.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.817 0.342 . . . . 10.0 110.581 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.3 m 70.37 24.36 4.71 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.469 -0.787 . . . . 10.0 111.893 179.358 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 p -72.25 137.38 46.76 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.835 -0.432 . . . . 10.0 109.835 179.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.473 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 16.7 mt-10 -100.4 107.08 18.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.182 0.515 . . . . 10.0 110.296 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.41 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 3.6 mm -97.38 118.93 44.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.384 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.437 ' CD2' ' HG2' ' A' ' 25' ' ' LYS . 41.9 m80 -96.35 96.21 8.59 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.994 0.426 . . . . 10.0 110.061 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.4 116.18 28.44 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.311 -0.404 . . . . 10.0 109.939 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -87.32 103.37 15.41 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.09 -0.505 . . . . 10.0 109.859 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.464 HG12 HD11 ' A' ' 47' ' ' LEU . 2.6 m -108.76 169.88 3.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.043 0.449 . . . . 10.0 111.743 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -117.79 143.41 46.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.096 -0.502 . . . . 10.0 109.836 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 54.3 tpp -78.23 65.26 3.54 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.372 0.606 . . . . 10.0 110.199 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 78.6 m -164.04 -46.81 0.03 OUTLIER 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.617 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.536 ' OG1' ' HB2' ' B' ' 366' ' ' ASP . 0.3 OUTLIER -68.29 147.17 52.56 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.427 -0.806 . . . . 10.0 111.611 -179.319 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 43.6 m80 -75.31 151.89 38.24 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.659 -0.496 . . . . 10.0 109.659 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.7 mt -70.95 -10.74 60.23 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.455 -0.339 . . . . 10.0 111.492 -179.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.59 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 41.8 tttp -63.06 -47.91 80.95 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.978 -0.379 . . . . 10.0 109.978 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -56.28 -40.61 74.54 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.948 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.464 HD11 HG12 ' A' ' 38' ' ' VAL . 3.6 mm? -64.03 -40.67 96.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.781 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -66.75 -47.25 72.84 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.923 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -69.81 -36.11 75.36 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.045 0.387 . . . . 10.0 112.045 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 49.4 m -75.59 -29.98 59.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.628 0.251 . . . . 10.0 111.397 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -65.14 -36.38 84.08 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.966 0.412 . . . . 10.0 110.512 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 63.2 m -60.02 -31.69 70.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.673 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -69.96 -31.25 68.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.901 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -67.76 -37.19 81.78 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.679 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -89.27 -14.32 36.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.352 -0.386 . . . . 10.0 111.269 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.94 36.14 29.16 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.896 -0.669 . . . . 10.0 112.392 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.1 m -123.71 159.78 54.21 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 110.561 -0.163 . . . . 10.0 110.561 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -68.27 167.22 22.73 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.221 1.947 . . . . 10.0 111.733 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.46 140.23 57.08 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.209 -179.365 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.8 t30 69.83 22.17 6.08 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.251 -0.886 . . . . 10.0 112.632 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.9 p -87.82 -23.17 24.11 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.44 0.638 . . . . 10.0 109.358 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 37.2 mt -117.69 134.98 54.33 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.372 -0.831 . . . . 10.0 109.786 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.429 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.2 ptt-85 -104.03 127.27 51.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.121 0.486 . . . . 10.0 110.393 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.458 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 87.4 m-85 -90.13 123.71 34.2 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.475 -0.784 . . . . 10.0 109.983 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.3 mt -110.51 118.35 36.01 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.106 0.479 . . . . 10.0 111.019 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -125.61 116.28 21.47 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.353 -0.84 . . . . 10.0 108.793 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 64.9 25.3 12.78 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.125 0.488 . . . . 10.0 110.737 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.19 -9.63 76.18 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.722 -0.672 . . . . 10.0 112.909 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -107.14 145.27 32.73 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 122.649 -0.324 . . . . 10.0 110.389 -179.4 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.458 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 14.2 ptm180 -82.5 137.03 34.74 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.234 0.54 . . . . 10.0 110.706 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.2 mm -71.64 119.92 18.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.848 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -74.32 164.22 26.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.427 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.59 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 0.1 OUTLIER -78.34 -1.8 35.04 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.985 0.421 . . . . 10.0 111.501 -179.016 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -121.87 16.1 10.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.254 0.55 . . . . 10.0 110.301 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -84.13 148.11 26.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.238 -179.557 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.555 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.3 OUTLIER -119.24 145.31 38.12 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.516 -0.765 . . . . 10.0 109.465 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.462 ' HD2' HG22 ' A' ' 76' ' ' THR . 31.2 Cg_exo -60.42 -16.07 39.58 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.415 2.076 . . . . 10.0 112.574 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -69.35 -42.86 74.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.741 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 76' ' ' THR . 8.8 pt-20 -84.25 177.26 8.26 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.432 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 11.0 mt 72.94 -54.62 0.69 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.1 0.56 . . . . 10.0 110.773 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 119.2 64.13 0.28 Allowed Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.976 -0.63 . . . . 10.0 112.652 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 47.9 mtt -97.79 135.04 40.13 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.828 0.347 . . . . 10.0 110.586 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 4.9 mm-40 -133.19 -176.29 4.08 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.2 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 38.8 tp10 -71.09 139.71 50.44 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.663 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 65.65 25.42 11.58 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.209 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -72.27 156.74 38.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.44 -0.345 . . . . 10.0 110.242 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.5 t -111.45 130.94 64.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.894 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.445 HD11 ' HB3' ' A' ' 64' ' ' PHE . 18.0 tt -137.15 142.31 37.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -102.35 150.69 23.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.89 0.376 . . . . 10.0 111.451 -178.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -131.61 124.61 54.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.877 -0.602 . . . . 10.0 109.533 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -127.36 158.16 38.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.425 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -87.63 130.92 34.61 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.865 0.364 . . . . 10.0 111.636 -178.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.429 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 6.4 mm-40 -71.9 143.5 49.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.879 -0.601 . . . . 10.0 109.97 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -68.32 -25.69 65.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.059 -0.519 . . . . 10.0 111.493 -179.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 32.5 p -71.88 -28.47 63.54 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.937 0.398 . . . . 10.0 110.967 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 80.61 10.4 85.27 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.937 -0.649 . . . . 10.0 111.98 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.949 0 CA-C-O 118.84 -0.978 . . . . 10.0 111.322 -179.862 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 55.7 t30 . . . . . 0 N--CA 1.483 1.186 0 CA-C-O 121.134 0.493 . . . . 10.0 110.26 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 358' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 50.1 t30 -120.69 123.76 43.52 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.557 -0.905 . . . . 10.0 108.557 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -125.91 127.08 45.44 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 360' ' ' ASP . . . . . 0.427 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 20.6 t0 -122.71 128.7 25.3 Favored Pre-proline 0 C--N 1.318 -0.776 0 N-CA-C 107.394 -1.336 . . . . 10.0 107.394 176.149 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 361' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 57.9 Cg_endo -111.14 128.79 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.184 0 C-N-CA 121.728 1.619 . . . . 10.0 113.638 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.2 mt -119.67 136.93 55.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 113.702 -1.59 . . . . 10.0 109.732 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -113.07 135.77 51.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.394 0.616 . . . . 10.0 109.643 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 5.2 tp -113.16 144.16 21.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.272 -0.876 . . . . 10.0 111.765 -176.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 366' ' ' ASP . . . . . 0.536 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 0.2 OUTLIER -113.77 131.32 56.25 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.968 -1.015 . . . . 10.0 112.026 -175.455 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 367' ' ' SEP . . . . . 0.403 ' HA ' ' HD3' ' B' ' 368' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 368' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' B' ' 367' ' ' SEP . 50.8 Cg_exo . . . . . 0 C--O 1.25 1.077 0 C-N-CA 123.211 2.607 . . . . 10.0 112.712 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 110.126 -0.324 . . . . 10.0 110.126 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.422 ' HB ' HG22 ' A' ' 38' ' ' VAL . 31.6 mm -102.79 108.98 25.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.431 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -93.87 96.3 9.65 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.207 0.527 . . . . 10.0 110.61 -179.301 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 45.0 mt -82.23 149.83 27.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.614 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -105.82 107.89 19.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.24 -0.437 . . . . 10.0 110.201 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.497 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.8 t -89.3 121.83 39.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.371 -0.603 . . . . 10.0 109.371 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.0 mm -86.83 110.85 20.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.904 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.82 159.77 44.26 Favored Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 120.871 -0.68 . . . . 10.0 111.553 179.21 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -62.68 -32.23 73.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.737 0.269 . . . . 10.0 111.525 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -91.75 27.65 2.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.883 0.373 . . . . 10.0 111.342 -179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.9 m 62.56 37.95 12.76 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.777 -0.647 . . . . 10.0 111.179 179.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.85 143.53 26.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.855 -0.611 . . . . 10.0 109.916 179.183 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.455 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 20.9 mt-10 -109.14 97.43 7.04 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.114 0.483 . . . . 10.0 110.654 -179.492 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.497 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 3.0 mm -87.28 127.06 40.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.907 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -103.22 102.6 12.59 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.021 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.19 116.39 30.31 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.7 ttmt -87.44 95.13 9.9 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.76 -0.655 . . . . 10.0 109.611 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.429 HG12 HD11 ' A' ' 47' ' ' LEU . 3.1 m -101.06 163.95 2.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.461 . . . . 10.0 111.516 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -113.83 142.4 46.14 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.869 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.405 ' O ' ' HB ' ' A' ' 41' ' ' THR . 54.3 tpp -80.42 76.8 7.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.999 0.428 . . . . 10.0 111.663 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.405 ' HB ' ' O ' ' A' ' 40' ' ' MET . 8.3 t 173.68 -35.54 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.883 178.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.21 132.65 42.37 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.14 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.7 m80 -64.69 155.95 31.85 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.034 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.402 HD12 ' HB3' ' A' ' 75' ' ' HIS . 48.3 mt -74.51 -0.9 19.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.737 0.303 . . . . 10.0 110.687 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.537 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 12.2 tptp -59.62 -57.33 13.42 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.148 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.403 ' HG3' HD11 ' B' ' 364' ' ' ILE . 4.7 tppp? -59.15 -35.39 73.42 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.482 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.429 HD11 HG12 ' A' ' 38' ' ' VAL . 4.3 mm? -64.67 -48.16 75.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.044 -0.525 . . . . 10.0 111.679 -179.193 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -58.39 -48.46 80.58 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.951 0.352 . . . . 10.0 111.951 -179.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 4.6 pt-20 -70.58 -31.37 68.35 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.015 0.376 . . . . 10.0 112.015 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.0 m -71.95 -36.91 70.01 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.942 -0.303 . . . . 10.0 110.974 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -64.98 -39.34 93.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.852 0.358 . . . . 10.0 110.092 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.419 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 58.6 m -62.1 -36.08 80.64 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 178.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -66.85 -39.12 87.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.348 179.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -63.38 -41.23 98.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.616 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -78.2 -16.42 57.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.817 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.03 31.83 41.81 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.888 -0.672 . . . . 10.0 112.431 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.7 m -128.34 158.06 72.61 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 110.648 -0.13 . . . . 10.0 110.648 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -64.98 161.62 36.02 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.37 2.046 . . . . 10.0 111.311 178.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.419 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 21.6 ttt -72.22 152.25 42.34 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.038 -0.265 . . . . 10.0 111.124 -179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 11.7 t30 79.13 -3.57 2.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.024 0.93 . . . . 10.0 111.924 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 81.1 p -78.28 -18.23 55.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.255 0.55 . . . . 10.0 109.795 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 56.9 mt -120.84 135.35 55.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.16 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.501 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 10.7 ptt180 -105.38 125.28 50.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.045 0.45 . . . . 10.0 110.323 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -88.28 117.59 27.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.885 179.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.3 mt -107.52 123.6 48.67 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.123 0.487 . . . . 10.0 110.346 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -127.27 98.61 5.34 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.582 -0.735 . . . . 10.0 109.839 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 62.29 49.13 4.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.279 -0.873 . . . . 10.0 111.351 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.02 -50.87 2.51 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.962 -0.637 . . . . 10.0 113.49 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -80.38 163.19 24.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.868 0.366 . . . . 10.0 111.34 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -101.91 152.4 20.96 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.375 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 46.2 mm -82.33 121.26 35.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.96 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -79.56 163.78 24.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.994 -0.548 . . . . 10.0 109.883 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.67 -21.0 61.14 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.837 0.351 . . . . 10.0 111.706 -179.204 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -100.83 5.37 43.43 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.697 -0.228 . . . . 10.0 111.235 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.402 ' HB3' HD12 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -74.65 149.03 40.15 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.599 -179.645 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 23.9 p -123.23 157.42 61.22 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.109 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -69.0 -8.06 22.55 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.514 2.143 . . . . 10.0 112.253 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -79.25 -35.97 40.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.773 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.473 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 7.8 pt-20 -92.21 173.03 8.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.037 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.473 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 52.2 mt 73.78 -42.39 0.51 Allowed 'General case' 0 N--CA 1.469 0.519 0 O-C-N 123.692 0.62 . . . . 10.0 110.947 -179.204 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 105.41 84.95 1.79 Allowed Glycine 0 N--CA 1.444 -0.824 0 C-N-CA 121.174 -0.536 . . . . 10.0 112.362 179.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 52.5 mtt -114.88 148.26 38.84 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.847 -0.427 . . . . 10.0 109.847 179.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.9 mm-40 -146.12 174.67 11.1 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.954 0.406 . . . . 10.0 110.971 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.431 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 20.7 tp10 -65.9 135.5 54.86 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.896 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 18.5 mm-40 69.26 25.65 5.58 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 123.574 0.546 . . . . 10.0 111.558 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.3 t0 -71.92 167.2 20.57 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.824 -0.351 . . . . 10.0 110.091 179.361 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.0 t -113.9 117.57 55.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 120.912 0.387 . . . . 10.0 111.836 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 16.9 tt -125.72 139.54 51.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.812 -0.631 . . . . 10.0 109.32 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -113.25 146.63 39.03 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.865 0.364 . . . . 10.0 111.1 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.2 p -133.92 130.76 55.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.145 -0.48 . . . . 10.0 109.811 179.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -134.49 166.6 22.5 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.34 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -76.29 141.47 41.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.685 0.278 . . . . 10.0 110.813 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.501 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 1.1 mm-40 -86.41 151.27 23.68 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.368 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -72.61 -22.08 61.01 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.231 0.539 . . . . 10.0 110.262 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -30.79 69.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.585 -0.734 . . . . 10.0 110.843 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 88.08 -9.99 72.58 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.892 -0.67 . . . . 10.0 113.051 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.837 0 CA-C-O 118.492 -1.171 . . . . 10.0 111.633 -179.807 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 121.075 0.464 . . . . 10.0 110.599 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -119.7 122.51 41.64 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.607 -0.437 . . . . 10.0 109.88 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 359' ' ' ARG . . . . . 0.455 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 14.7 ptt180 -124.94 128.59 48.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.247 0.546 . . . . 10.0 112.309 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 360' ' ' ASP . . . . . 0.425 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 32.4 t0 -123.41 128.57 25.19 Favored Pre-proline 0 C--N 1.32 -0.708 0 N-CA-C 107.601 -1.259 . . . . 10.0 107.601 177.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 361' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 67.3 Cg_endo -107.91 127.61 0.05 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 121.545 1.497 . . . . 10.0 112.868 -179.074 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 3.0 mt -117.9 136.96 53.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 114.364 -1.289 . . . . 10.0 110.186 -178.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 40.7 t -112.54 135.57 51.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.477 0.656 . . . . 10.0 110.312 -178.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 364' ' ' ILE . . . . . 0.403 HD11 ' HG3' ' A' ' 46' ' ' LYS . 7.9 tp -112.31 144.83 19.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 114.444 -1.253 . . . . 10.0 110.729 -177.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -114.24 131.29 56.53 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.829 -1.078 . . . . 10.0 111.313 -176.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 367' ' ' SEP . . . . . 0.413 ' HA ' ' HD3' ' B' ' 368' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 368' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' B' ' 367' ' ' SEP . 75.2 Cg_exo . . . . . 0 C--O 1.251 1.149 0 C-N-CA 123.479 2.786 . . . . 10.0 113.145 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.688 0.28 . . . . 10.0 110.357 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.1 mm -100.95 116.84 45.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.634 ' HE2' ' ND1' ' A' ' 35' ' ' HIS . 0.4 OUTLIER -100.43 105.56 17.05 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.119 0.485 . . . . 10.0 110.763 -179.481 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.8 mt -88.57 150.85 22.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.21 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 44.1 mtpt -110.19 119.59 39.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.0 0.429 . . . . 10.0 110.454 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.7 t -102.11 131.35 50.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.712 -0.677 . . . . 10.0 109.44 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.8 mm -101.33 118.31 47.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.899 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.4 155.81 25.36 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.981 -0.628 . . . . 10.0 112.153 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -65.79 -20.73 66.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.008 0.432 . . . . 10.0 111.053 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -89.84 12.59 16.81 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.777 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.9 m 71.22 39.58 0.94 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.533 -0.758 . . . . 10.0 111.578 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 20.7 p -102.84 140.52 37.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.243 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -107.91 99.46 8.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.121 0.486 . . . . 10.0 109.985 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.0 mm -89.04 134.22 29.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.151 -178.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.634 ' ND1' ' HE2' ' A' ' 23' ' ' LYS . 97.5 m-70 -111.44 105.97 14.74 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.603 -0.518 . . . . 10.0 109.603 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -104.02 117.62 34.73 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.875 0.369 . . . . 10.0 110.487 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.9 ttmt -89.58 100.5 13.29 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.119 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 m -103.2 170.18 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.515 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -121.2 142.73 49.62 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 110.079 -0.341 . . . . 10.0 110.079 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.467 ' O ' ' HB ' ' A' ' 41' ' ' THR . 48.7 tpp -74.96 71.39 2.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.442 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.467 ' HB ' ' O ' ' A' ' 40' ' ' MET . 10.1 t 171.86 -29.96 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.278 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.08 139.48 44.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.205 -179.464 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -68.02 137.57 55.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.231 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.477 HD12 ' HB3' ' A' ' 75' ' ' HIS . 63.9 mt -68.08 -9.23 44.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.347 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.0 tptt -58.53 -47.1 85.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.297 0.57 . . . . 10.0 109.471 178.174 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -65.42 -34.46 78.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.236 -0.893 . . . . 10.0 110.539 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.414 HD13 ' HA ' ' A' ' 47' ' ' LEU . 4.3 mm? -68.66 -45.32 72.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.822 -0.626 . . . . 10.0 111.173 -179.288 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -61.56 -45.67 93.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.812 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.433 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 11.1 pt-20 -70.08 -40.27 75.09 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.937 -0.305 . . . . 10.0 111.371 -179.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.3 m -61.91 -34.82 76.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.818 0.342 . . . . 10.0 110.772 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -65.79 -40.73 92.24 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.673 -0.492 . . . . 10.0 109.673 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 57.9 m -63.92 -39.78 94.95 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.255 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 49' ' ' GLU . 79.7 mt-30 -65.26 -41.62 94.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.411 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -64.77 -37.45 87.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.938 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.424 ' HB2' HG22 ' A' ' 57' ' ' VAL . 15.0 mm100 -85.75 -3.32 58.87 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.03 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.3 39.65 98.08 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.234 -0.507 . . . . 10.0 112.516 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.424 HG22 ' HB2' ' A' ' 55' ' ' GLN . 4.3 m -124.14 156.2 66.69 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.474 ' HG2' ' HB3' ' A' ' 61' ' ' SER . 11.0 Cg_endo -58.36 165.41 7.48 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.697 2.264 . . . . 10.0 112.431 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 22.4 ttt -69.1 132.28 46.33 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.617 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.0 t30 66.29 25.5 10.49 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.271 -0.877 . . . . 10.0 111.996 179.022 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.474 ' HB3' ' HG2' ' A' ' 58' ' ' PRO . 12.6 p -77.32 -22.32 52.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.564 0.697 . . . . 10.0 109.816 178.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.9 mt -117.92 141.59 48.27 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.082 -0.963 . . . . 10.0 110.372 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.441 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 20.5 ptt-85 -104.87 128.7 53.17 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.751 178.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -94.5 123.97 38.24 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.163 -0.472 . . . . 10.0 110.014 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.7 mt -112.26 121.6 45.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.894 -179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -124.15 113.56 18.5 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.365 -0.834 . . . . 10.0 108.866 178.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.401 ' OE1' ' HA ' ' A' ' 67' ' ' GLU . 4.1 mm-40 63.12 28.75 16.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.253 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 88.0 -4.89 85.47 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 121.088 -0.577 . . . . 10.0 113.126 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -109.33 145.96 35.15 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.948 -0.39 . . . . 10.0 109.948 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -85.86 139.54 31.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.194 0.521 . . . . 10.0 110.795 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.5 mm -74.91 121.5 26.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.881 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -75.29 164.39 26.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.014 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.87 -27.09 60.11 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.698 0.285 . . . . 10.0 111.089 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 -99.99 22.88 10.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.962 0.411 . . . . 10.0 110.562 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.477 ' HB3' HD12 ' A' ' 44' ' ' LEU . 1.5 m170 -85.03 157.05 20.85 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.109 0.481 . . . . 10.0 111.309 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.548 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.2 OUTLIER -134.56 152.3 77.55 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.742 179.108 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -63.11 -13.15 33.67 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.583 2.189 . . . . 10.0 113.013 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.0 tppt? -69.63 -40.98 76.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.441 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.548 ' HG2' ' O ' ' A' ' 76' ' ' THR . 7.6 pt-20 -85.36 169.01 14.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.095 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 22.8 mt 73.78 -60.06 0.54 Allowed 'General case' 0 N--CA 1.468 0.427 0 O-C-N 123.828 0.705 . . . . 10.0 110.599 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 119.79 76.76 0.49 Allowed Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.936 -0.65 . . . . 10.0 112.177 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 65.1 mtt -104.08 118.04 35.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.726 0.298 . . . . 10.0 110.489 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.452 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 17.4 mm-40 -112.51 -177.67 3.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.663 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.49 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 38.6 tp10 -73.85 140.62 45.86 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.224 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 20.3 mm-40 70.49 20.79 5.8 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.638 0.586 . . . . 10.0 111.009 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.6 OUTLIER -71.98 150.24 44.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.077 179.568 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 40.2 t -109.4 122.28 63.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.079 0.466 . . . . 10.0 111.572 -178.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.8 tt -121.65 142.15 39.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -102.58 145.8 29.09 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.711 0.291 . . . . 10.0 111.353 -178.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.4 p -130.46 125.55 59.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.188 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -133.66 156.57 47.67 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.223 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.67 142.24 38.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.79 0.329 . . . . 10.0 111.219 -179.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.441 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.9 mm-40 -81.18 149.62 29.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.411 179.508 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -66.43 -37.15 84.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.106 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 6.4 p -76.38 -12.27 60.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.498 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 84.94 -10.22 63.54 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.835 -0.698 . . . . 10.0 112.092 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.939 0 N-CA-C 110.922 -0.871 . . . . 10.0 110.922 -179.834 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 . . . . . 0 N--CA 1.479 1.023 0 CA-C-O 121.359 0.599 . . . . 10.0 110.35 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -118.5 126.69 52.55 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 108.179 -1.045 . . . . 10.0 108.179 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -124.86 128.07 48.11 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 113.162 0.801 . . . . 10.0 113.162 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -124.0 127.43 25.39 Favored Pre-proline 0 C--N 1.314 -0.943 0 N-CA-C 107.429 -1.323 . . . . 10.0 107.429 175.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -109.81 127.85 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.22 0 C-N-CA 121.779 1.652 . . . . 10.0 113.021 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.5 mt -118.64 136.01 57.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 114.182 -1.372 . . . . 10.0 110.056 -179.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 13.6 t -113.02 137.2 46.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 108.972 -0.751 . . . . 10.0 108.972 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 364' ' ' ILE . . . . . 0.409 ' HA ' HD12 ' B' ' 364' ' ' ILE . 6.4 tp -110.82 147.46 14.89 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 114.867 -1.061 . . . . 10.0 111.696 -176.021 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -111.74 128.05 55.97 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.871 -1.058 . . . . 10.0 110.649 -176.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 367' ' ' SEP . . . . . 0.414 ' HA ' ' HD3' ' B' ' 368' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 368' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' B' ' 367' ' ' SEP . 51.6 Cg_exo . . . . . 0 C--O 1.246 0.92 0 C-N-CA 123.017 2.478 . . . . 10.0 112.179 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.3 mm -105.48 114.01 43.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.379 -0.6 . . . . 10.0 109.379 179.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.436 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.7 ttpm? -99.62 103.05 14.73 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.029 0.442 . . . . 10.0 110.506 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 21.8 mt -88.2 153.13 21.48 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.716 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.9 mtpt -107.41 111.15 23.33 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.297 -0.41 . . . . 10.0 109.982 179.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.433 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.6 t -95.41 125.82 48.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.874 -0.603 . . . . 10.0 109.62 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.1 mm -95.83 118.87 43.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 120.966 0.413 . . . . 10.0 110.63 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.76 164.75 36.03 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.815 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -62.27 -27.96 69.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.651 0.263 . . . . 10.0 111.378 -179.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -91.56 24.4 3.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.451 -0.34 . . . . 10.0 110.808 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.1 m 61.83 38.37 14.77 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.873 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -93.33 145.02 24.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.969 -0.56 . . . . 10.0 109.831 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.501 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 4.3 mt-10 -113.48 98.42 7.07 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.228 0.537 . . . . 10.0 110.337 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.433 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 3.8 mm -87.13 128.13 40.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.723 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.9 m170 -99.13 94.58 6.58 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.633 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.75 113.31 25.35 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.833 0.349 . . . . 10.0 110.21 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -92.68 103.93 16.26 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.418 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 m -104.38 170.15 2.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.871 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -119.0 139.99 50.77 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 56.8 tpp -76.81 62.7 2.08 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.167 0.508 . . . . 10.0 110.379 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 m -163.15 -38.19 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.219 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.435 ' OG1' ' HB2' ' B' ' 366' ' ' ASP . 0.2 OUTLIER -80.85 152.24 28.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.721 -0.672 . . . . 10.0 112.172 -178.954 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -80.67 152.69 28.32 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.551 -0.749 . . . . 10.0 109.536 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.9 mt -69.66 -6.7 33.24 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.813 0.301 . . . . 10.0 111.813 -179.003 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.418 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 50.0 tptt -60.15 -51.31 70.14 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.827 -0.434 . . . . 10.0 109.827 178.619 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.424 ' HG3' HD11 ' B' ' 364' ' ' ILE . 4.8 tppp? -62.63 -33.51 75.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.539 -0.755 . . . . 10.0 110.651 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.51 -47.13 67.78 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.07 -0.514 . . . . 10.0 111.57 -179.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -61.82 -45.19 94.92 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.07 0.396 . . . . 10.0 112.07 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 9.8 pt-20 -68.78 -35.14 76.68 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.75 0.278 . . . . 10.0 111.75 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 64.6 m -68.68 -33.02 73.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.755 0.312 . . . . 10.0 110.712 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.432 ' CG ' ' HZ ' ' A' ' 64' ' ' PHE . 30.5 t80 -68.54 -42.25 78.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.937 0.398 . . . . 10.0 110.185 179.315 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 56.0 m -60.91 -41.82 96.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.954 -0.567 . . . . 10.0 110.216 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -67.08 -30.76 70.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.79 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -69.47 -39.71 77.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.651 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -82.26 -15.75 51.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.216 -179.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.07 39.15 10.32 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.653 -0.784 . . . . 10.0 112.387 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.2 m -135.85 153.49 77.19 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 110.08 -0.341 . . . . 10.0 110.08 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -66.29 159.1 51.64 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.232 1.954 . . . . 10.0 111.103 178.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.41 ' SD ' ' HB3' ' A' ' 49' ' ' GLU . 17.2 ttt -68.03 159.53 30.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.714 0.292 . . . . 10.0 111.252 -179.265 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.0 t30 79.7 -16.9 0.62 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.163 0.985 . . . . 10.0 111.743 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 81.0 p -68.49 -37.73 80.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.122 0.487 . . . . 10.0 110.026 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 94.1 mt -102.6 125.33 49.29 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.577 -0.738 . . . . 10.0 110.308 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.504 ' HD3' ' OE2' ' A' ' 93' ' ' GLU . 18.2 ptt180 -106.18 124.78 50.12 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.145 0.498 . . . . 10.0 110.417 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.432 ' HZ ' ' CG ' ' A' ' 51' ' ' TYR . 50.7 m-85 -86.51 126.61 34.56 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.483 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 82.5 mt -113.43 127.7 56.2 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.174 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -135.38 115.72 13.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.464 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 62.3 29.36 17.32 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.529 0.518 . . . . 10.0 110.925 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.32 -37.23 3.48 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.967 -0.635 . . . . 10.0 112.885 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -81.02 158.72 25.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.7 0.286 . . . . 10.0 110.621 -179.389 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.0 ptm180 -96.54 140.66 30.84 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.979 0.419 . . . . 10.0 110.174 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.0 mm -74.15 123.95 30.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.414 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.58 166.9 17.82 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.51 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -81.08 -3.25 51.29 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.933 -178.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.7 p-10 -115.88 4.79 13.93 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.841 0.353 . . . . 10.0 110.624 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 21.5 m170 -78.45 152.57 32.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.398 -179.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.495 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 11.2 p -123.41 153.98 65.75 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.172 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -66.6 -14.28 43.35 Favored 'Trans proline' 0 N--CA 1.472 0.236 0 C-N-CA 122.484 2.123 . . . . 10.0 112.639 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -73.93 -30.65 62.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.538 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 76' ' ' THR . 13.9 pt-20 -98.6 173.49 6.9 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.738 -0.467 . . . . 10.0 109.738 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.432 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 58.4 mt 73.01 -46.96 0.66 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 123.634 0.584 . . . . 10.0 111.235 -179.583 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 112.4 77.03 0.81 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 121.092 -0.575 . . . . 10.0 112.732 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 56.5 mtt -111.67 115.72 29.59 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.748 0.308 . . . . 10.0 110.35 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 25.1 mm-40 -114.35 177.62 4.58 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.069 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.439 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 29.1 tp10 -69.7 139.11 53.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.076 179.397 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 13.1 mm-40 70.57 11.85 7.32 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 123.483 0.49 . . . . 10.0 111.927 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.3 OUTLIER -68.8 147.61 51.51 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.97 -0.292 . . . . 10.0 110.309 179.705 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 92.6 t -98.1 126.39 51.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 121.241 0.543 . . . . 10.0 111.59 -178.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.5 tt -126.39 142.9 41.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.53 -0.759 . . . . 10.0 109.136 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -108.18 157.21 18.51 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.101 0.477 . . . . 10.0 111.841 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.4 p -146.85 125.39 4.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.436 178.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -133.98 169.38 17.2 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.387 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -81.58 134.65 35.52 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.848 0.356 . . . . 10.0 110.965 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.504 ' OE2' ' HD3' ' A' ' 63' ' ' ARG . 2.6 mm-40 -69.42 173.91 5.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.565 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -78.44 -31.35 48.01 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.921 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 16.6 p -72.46 -33.32 66.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.568 -0.742 . . . . 10.0 111.321 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.78 6.32 80.03 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 110.96 -0.856 . . . . 10.0 110.96 -178.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.978 0 N-CA-C 110.716 -0.953 . . . . 10.0 110.716 -179.788 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 66.3 t30 . . . . . 0 N--CA 1.483 1.177 0 CA-C-O 121.283 0.563 . . . . 10.0 110.988 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 358' ' ' ASN . . . . . 0.501 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 5.9 t-20 -120.34 121.09 37.83 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 108.468 -0.938 . . . . 10.0 108.468 178.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 359' ' ' ARG . . . . . 0.44 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 16.8 ptt180 -128.66 129.57 46.02 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 113.327 0.862 . . . . 10.0 113.327 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -122.54 130.44 24.66 Favored Pre-proline 0 C--N 1.317 -0.823 0 N-CA-C 107.872 -1.159 . . . . 10.0 107.872 176.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -108.36 127.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 121.246 1.297 . . . . 10.0 113.719 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.2 mt -119.26 135.08 60.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 114.407 -1.27 . . . . 10.0 109.93 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 21.0 t -114.49 135.24 54.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 N-CA-C 109.014 -0.735 . . . . 10.0 109.014 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 364' ' ' ILE . . . . . 0.424 HD11 ' HG3' ' A' ' 46' ' ' LYS . 6.5 tp -113.78 144.43 21.4 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 CA-C-N 115.082 -0.963 . . . . 10.0 111.502 -176.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 365' ' ' SEP . . . . . 0.403 ' P ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 366' ' ' ASP . . . . . 0.435 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 4.7 t70 -112.09 130.15 55.98 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.123 -0.944 . . . . 10.0 111.836 -175.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 367' ' ' SEP . . . . . 0.448 ' HA ' ' HD3' ' B' ' 368' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 368' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' B' ' 367' ' ' SEP . 16.2 Cg_exo . . . . . 0 C--O 1.248 0.994 0 C-N-CA 122.591 2.194 . . . . 10.0 110.96 178.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 110.382 -0.229 . . . . 10.0 110.382 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.5 mm -110.95 118.87 58.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -100.4 108.71 20.78 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.119 0.485 . . . . 10.0 111.624 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.8 mt -91.46 147.66 22.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.546 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt -105.25 104.58 14.33 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.077 0.465 . . . . 10.0 110.363 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.45 ' O ' HG12 ' A' ' 34' ' ' ILE . 3.6 t -87.77 125.97 41.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.685 -0.689 . . . . 10.0 109.369 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.6 mm -99.44 116.05 41.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 120.888 0.375 . . . . 10.0 110.575 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.84 169.66 42.81 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.719 -0.753 . . . . 10.0 111.93 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -60.02 -33.17 71.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.357 . . . . 10.0 111.486 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -86.69 23.25 1.72 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.572 -179.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 72.2 m 61.37 32.21 19.13 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.259 0.552 . . . . 10.0 111.066 179.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.03 140.1 31.28 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.73 -0.668 . . . . 10.0 109.714 179.303 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.491 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 12.8 mt-10 -107.62 96.47 6.42 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.106 0.479 . . . . 10.0 110.251 -179.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 26' ' ' VAL . 1.2 mm -82.66 127.44 39.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.657 -179.169 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -96.17 87.68 4.6 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.36 106.26 17.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.336 -179.251 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -92.2 104.69 17.03 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.946 0.403 . . . . 10.0 110.701 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 5.1 m -103.45 167.16 2.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.202 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 64.8 tttt -117.31 137.8 52.19 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 110.164 -0.31 . . . . 10.0 110.164 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.438 ' O ' ' HB ' ' A' ' 41' ' ' THR . 57.6 tpp -75.11 76.13 2.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.014 0.435 . . . . 10.0 110.711 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.438 ' HB ' ' O ' ' A' ' 40' ' ' MET . 8.7 t 173.13 -30.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.127 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.67 145.86 28.56 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.406 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -76.43 147.32 38.03 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.189 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.416 HD12 ' HB3' ' A' ' 75' ' ' HIS . 49.2 mt -69.02 -7.33 34.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.951 0.405 . . . . 10.0 110.657 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 28.2 tptt -56.15 -52.58 63.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.24 178.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.462 ' HZ3' ' P ' ' B' ' 367' ' ' SEP . 23.4 ttpt -69.9 -32.83 71.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.685 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.473 ' HA ' HD13 ' A' ' 47' ' ' LEU . 3.3 mm? -63.87 -39.47 94.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.273 -0.421 . . . . 10.0 111.045 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -61.69 -44.27 97.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.67 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -76.03 -28.67 57.81 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 121.017 -0.273 . . . . 10.0 111.368 -179.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.411 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 66.4 m -63.24 -38.7 92.18 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.952 0.406 . . . . 10.0 111.008 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -67.07 -35.33 79.59 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.898 -0.408 . . . . 10.0 109.898 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.474 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.9 m -62.19 -40.57 96.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.736 -0.666 . . . . 10.0 109.895 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.411 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.3 mt-30 -64.21 -41.08 97.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.527 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -66.95 -32.41 73.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.176 -0.466 . . . . 10.0 110.678 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -84.84 -11.85 54.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.129 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.93 32.31 63.69 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.994 -0.622 . . . . 10.0 112.266 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.9 m -131.37 154.59 81.96 Favored Pre-proline 0 C--N 1.324 -0.543 0 N-CA-C 110.54 -0.171 . . . . 10.0 110.54 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -64.27 164.29 23.37 Favored 'Trans proline' 0 CA--C 1.53 0.277 0 C-N-CA 122.449 2.099 . . . . 10.0 111.577 178.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.474 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 11.6 ttt -72.61 157.83 36.82 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 121.236 -0.186 . . . . 10.0 110.934 -179.346 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.3 t30 75.12 5.35 4.25 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.525 0.73 . . . . 10.0 111.947 178.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 55.6 p -86.69 -26.36 24.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.371 0.605 . . . . 10.0 109.926 179.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 48.7 mt -117.35 143.23 46.18 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.406 -0.815 . . . . 10.0 110.678 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.522 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 14.2 ptt-85 -115.42 127.7 55.54 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.284 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.459 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 25.3 m-85 -90.37 121.72 32.61 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.061 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 55.4 mt -107.94 111.44 23.54 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.128 0.489 . . . . 10.0 110.709 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -121.7 121.84 38.23 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.409 -0.814 . . . . 10.0 109.022 179.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 63.2 19.34 11.61 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.434 0.459 . . . . 10.0 110.962 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.62 -21.86 43.88 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.925 -0.655 . . . . 10.0 112.585 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -98.14 161.23 13.82 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.572 0.225 . . . . 10.0 110.636 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.459 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 13.3 ptm180 -95.46 143.45 26.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.017 0.437 . . . . 10.0 110.698 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.3 mm -77.95 127.36 38.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.646 -0.706 . . . . 10.0 111.803 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.94 166.44 13.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.33 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.479 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -73.35 -13.64 61.14 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.659 0.266 . . . . 10.0 111.521 -179.284 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -105.64 10.7 32.84 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.791 0.329 . . . . 10.0 111.229 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.416 ' HB3' HD12 ' A' ' 44' ' ' LEU . 1.6 m170 -83.65 149.03 26.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.102 0.477 . . . . 10.0 111.124 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.421 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -129.42 148.09 67.82 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.692 178.888 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 76' ' ' THR . 24.3 Cg_exo -64.32 -6.69 12.21 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.718 2.279 . . . . 10.0 112.798 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.9 tppt? -75.15 -27.27 59.65 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.902 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 76' ' ' THR . 3.2 pt-20 -108.69 -174.99 2.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.556 -179.397 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 41.0 mt 72.17 -58.49 0.59 Allowed 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.894 0.746 . . . . 10.0 110.922 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 129.36 61.16 0.1 Allowed Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 111.693 -0.563 . . . . 10.0 111.693 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 39.8 mtt -98.16 126.22 43.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.935 0.398 . . . . 10.0 110.644 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.493 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -129.84 173.27 10.83 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.364 179.893 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -66.17 138.33 57.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.235 -0.439 . . . . 10.0 109.834 179.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 69.63 25.89 5.13 Favored 'General case' 0 C--O 1.233 0.198 0 O-C-N 123.65 0.594 . . . . 10.0 111.546 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.493 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.6 OUTLIER -74.5 146.33 42.81 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 179.19 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 41.6 t -99.48 126.07 52.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.03 0.443 . . . . 10.0 111.186 -179.156 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.7 tt -135.36 143.01 38.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.971 -0.559 . . . . 10.0 109.683 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -110.47 153.62 24.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.018 0.437 . . . . 10.0 110.848 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.9 p -132.42 129.61 59.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.624 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -125.32 165.21 18.77 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.474 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -91.03 132.92 35.71 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.293 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.522 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.9 mm-40 -77.17 152.82 34.66 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.85 0.357 . . . . 10.0 110.807 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -77.64 -14.43 59.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.301 0.572 . . . . 10.0 110.024 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.6 p -71.36 -43.73 66.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.53 -0.759 . . . . 10.0 110.706 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 102.9 -16.21 54.62 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.989 -0.625 . . . . 10.0 112.324 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.933 0 CA-C-O 118.897 -0.946 . . . . 10.0 111.337 -179.617 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 . . . . . 0 N--CA 1.484 1.225 0 CA-C-O 121.044 0.45 . . . . 10.0 110.837 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -120.29 123.13 42.4 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.509 -0.923 . . . . 10.0 108.509 178.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 359' ' ' ARG . . . . . 0.491 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 27.4 ptt180 -126.25 127.86 46.28 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 119.904 -0.718 . . . . 10.0 111.922 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 360' ' ' ASP . . . . . 0.456 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 34.5 t70 -120.87 130.59 24.78 Favored Pre-proline 0 C--N 1.317 -0.819 0 N-CA-C 106.276 -1.749 . . . . 10.0 106.276 177.1 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 361' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 61.2 Cg_endo -108.05 129.22 0.05 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.281 0 C-N-CA 121.589 1.526 . . . . 10.0 114.005 -177.671 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 23.6 mt -119.08 132.09 69.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 CA-C-N 114.32 -1.309 . . . . 10.0 109.971 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 10.5 t -117.28 135.97 55.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 109.495 -0.557 . . . . 10.0 109.495 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 364' ' ' ILE . . . . . 0.421 HD12 ' HA ' ' B' ' 364' ' ' ILE . 5.4 tp -112.71 146.65 17.16 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 CA-C-N 114.93 -1.032 . . . . 10.0 110.945 -177.009 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -110.44 130.23 55.6 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.281 -0.872 . . . . 10.0 111.636 -174.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 367' ' ' SEP . . . . . 0.462 ' P ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo . . . . . 0 C--O 1.252 1.182 0 C-N-CA 122.509 2.139 . . . . 10.0 111.477 178.798 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 . . . . . 0 N--CA 1.482 1.167 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.4 mm -107.6 110.12 30.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.89 0.376 . . . . 10.0 110.089 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.423 ' NZ ' ' HB3' ' A' ' 23' ' ' LYS . 1.7 ttpm? -100.05 100.45 11.33 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.159 0.504 . . . . 10.0 110.513 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 33.3 mt -83.27 152.22 25.25 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.101 -179.211 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 40.4 mtpt -110.11 108.85 19.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.06 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.413 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.1 t -90.39 131.07 38.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.274 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.4 mm -89.98 110.83 22.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.464 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -76.14 152.9 42.57 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.846 -0.615 . . . . 10.0 112.172 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -61.88 -22.51 65.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.834 0.349 . . . . 10.0 111.553 -179.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -97.29 20.82 10.88 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.841 0.353 . . . . 10.0 110.569 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.2 m 67.42 44.94 1.67 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.605 -0.725 . . . . 10.0 111.128 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.8 p -107.3 149.74 27.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.634 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 10.0 mt-10 -107.5 101.95 11.26 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.41 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 5.6 mm -92.21 125.94 44.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.269 -179.362 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 23.5 m-70 -102.01 101.96 12.41 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.747 -0.464 . . . . 10.0 109.747 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.73 113.98 26.3 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.458 -179.38 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -85.7 99.51 11.36 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.867 -0.42 . . . . 10.0 109.867 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 m -106.13 168.88 2.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.996 -179.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.46 ' HE2' ' OG1' ' A' ' 41' ' ' THR . 79.1 tttt -120.0 143.2 48.18 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.855 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 58.9 tpp -76.74 58.56 1.44 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.347 0.594 . . . . 10.0 110.507 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.46 ' OG1' ' HE2' ' A' ' 39' ' ' LYS . 5.7 m -158.07 -42.11 0.06 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.513 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.3 147.94 37.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.837 -0.619 . . . . 10.0 111.251 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.462 ' HA ' HG22 ' A' ' 76' ' ' THR . 7.3 m80 -75.92 151.98 37.2 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.585 ' HA ' HD23 ' A' ' 47' ' ' LEU . 12.6 mt -66.33 -12.45 56.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.753 0.311 . . . . 10.0 111.36 -179.532 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 43.4 tptt -59.12 -44.4 92.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.156 0.503 . . . . 10.0 109.67 178.129 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -64.69 -32.72 74.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.204 -0.907 . . . . 10.0 110.655 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.585 HD23 ' HA ' ' A' ' 44' ' ' LEU . 2.5 mm? -74.96 -41.78 58.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.965 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -60.64 -47.71 85.04 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.898 -179.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -67.31 -46.73 72.65 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.946 0.35 . . . . 10.0 111.946 -178.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.7 m -61.09 -36.38 79.51 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.724 0.268 . . . . 10.0 111.724 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -64.65 -45.84 85.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.774 0.321 . . . . 10.0 110.465 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 60.3 m -59.93 -49.23 78.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.659 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -58.37 -39.88 80.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.128 0.489 . . . . 10.0 110.789 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -64.53 -39.58 94.03 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.154 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -80.3 -6.07 57.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.284 -0.416 . . . . 10.0 111.809 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.91 37.95 17.48 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.654 -0.784 . . . . 10.0 112.694 179.455 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -139.65 150.72 64.22 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 110.028 -0.36 . . . . 10.0 110.028 179.319 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.06 162.15 34.76 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.163 1.909 . . . . 10.0 111.424 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.495 ' HG3' ' N ' ' A' ' 60' ' ' ASN . 0.9 OUTLIER -62.84 147.83 48.91 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.893 -0.14 . . . . 10.0 110.637 179.431 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.495 ' N ' ' HG3' ' A' ' 59' ' ' MET . 35.7 t30 83.62 6.11 0.73 Allowed 'General case' 0 N--CA 1.475 0.823 0 O-C-N 124.069 0.856 . . . . 10.0 112.012 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 57.6 p -90.1 -33.88 16.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.041 0.448 . . . . 10.0 110.294 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 92' ' ' GLN . 33.6 mt -115.2 146.46 41.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.675 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.524 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 15.0 ptt-85 -117.02 135.64 53.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.217 179.131 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -93.98 127.23 39.64 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.169 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.0 mt -109.86 124.15 50.83 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.552 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -138.04 121.69 17.43 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.385 -0.825 . . . . 10.0 109.208 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 61.91 24.97 14.95 Favored 'General case' 0 C--N 1.331 -0.221 0 O-C-N 123.483 0.49 . . . . 10.0 110.989 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.63 2.0 87.2 Favored Glycine 0 CA--C 1.522 0.474 0 C-N-CA 121.115 -0.564 . . . . 10.0 113.07 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -114.19 164.93 13.21 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.945 0.372 . . . . 10.0 110.572 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -100.3 130.26 46.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.015 0.435 . . . . 10.0 110.217 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.9 mm -67.57 124.44 22.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.383 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -85.08 172.76 11.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.304 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 2.6 m-20 -80.88 -15.45 56.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.883 0.373 . . . . 10.0 111.205 -179.273 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -107.49 30.18 6.5 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.219 0.533 . . . . 10.0 110.577 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.412 ' HB3' HD12 ' A' ' 44' ' ' LEU . 2.6 m170 -104.47 152.62 22.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.972 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.462 HG22 ' HA ' ' A' ' 43' ' ' HIS . 6.1 p -130.1 153.81 81.17 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.966 178.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -62.88 -13.78 36.85 Favored 'Trans proline' 0 N--CA 1.475 0.414 0 C-N-CA 122.701 2.267 . . . . 10.0 112.865 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -72.35 -34.36 67.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.839 -179.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 76' ' ' THR . 6.0 pt-20 -94.72 174.34 7.16 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.935 -0.395 . . . . 10.0 109.935 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 15.9 mt 73.84 -41.38 0.48 Allowed 'General case' 0 N--CA 1.468 0.431 0 O-C-N 123.684 0.615 . . . . 10.0 111.249 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 107.79 56.32 0.6 Allowed Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.883 -0.675 . . . . 10.0 112.341 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 47.5 mtt -90.5 128.91 36.68 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.508 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.3 mm-40 -126.56 -179.91 5.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.089 0.471 . . . . 10.0 111.635 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -68.07 140.02 56.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.645 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 62.01 23.61 13.94 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.024 -0.535 . . . . 10.0 111.709 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.508 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.7 t0 -70.75 148.88 47.48 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.204 -0.198 . . . . 10.0 110.548 179.738 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 89.7 t -97.61 114.02 33.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.036 0.446 . . . . 10.0 111.59 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.413 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 18.8 tt -119.61 142.48 34.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -110.83 151.94 27.24 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.029 0.443 . . . . 10.0 111.636 -178.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.2 p -136.25 125.54 38.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.64 179.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -131.8 157.24 44.39 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.409 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.422 ' HA ' HD23 ' A' ' 62' ' ' LEU . 6.2 tt0 -75.97 138.89 41.24 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.904 0.383 . . . . 10.0 110.845 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.524 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.2 mm-40 -81.05 147.84 29.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.714 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -70.72 -15.4 62.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.08 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.31 -16.72 58.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.962 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.12 -47.3 3.55 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.963 -0.637 . . . . 10.0 112.352 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.821 0 N-CA-C 110.612 -0.995 . . . . 10.0 110.612 179.993 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 . . . . . 0 N--CA 1.477 0.9 0 CA-C-O 121.244 0.545 . . . . 10.0 109.912 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 358' ' ' ASN . . . . . 0.437 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 53.4 t-20 -121.7 123.86 42.87 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.192 -1.04 . . . . 10.0 108.192 179.065 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -123.12 122.72 39.15 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.414 -0.914 . . . . 10.0 112.811 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 360' ' ' ASP . . . . . 0.417 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 18.5 t70 -128.82 128.39 23.46 Favored Pre-proline 0 C--N 1.319 -0.755 0 N-CA-C 107.398 -1.334 . . . . 10.0 107.398 174.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 361' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 54.0 Cg_endo -111.72 128.44 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.141 0 C-N-CA 121.551 1.501 . . . . 10.0 113.789 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.1 mt -117.48 135.61 57.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.06 -0.973 . . . . 10.0 109.311 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 19.6 t -113.99 133.51 59.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.569 0.699 . . . . 10.0 110.626 -178.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 4.7 tp -116.27 143.05 27.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 114.985 -1.007 . . . . 10.0 111.014 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -110.09 128.6 55.53 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.506 0.669 . . . . 10.0 111.381 -175.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo . . . . . 0 C--O 1.248 1.012 0 C-N-CA 123.424 2.75 . . . . 10.0 112.749 179.719 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 . . . . . 0 N--CA 1.479 1.019 0 N-CA-C 110.246 -0.279 . . . . 10.0 110.246 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.1 mm -118.52 117.41 54.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.535 ' HZ2' ' CD ' ' A' ' 84' ' ' GLU . 0.0 OUTLIER -97.93 108.75 21.52 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.92 0.391 . . . . 10.0 110.855 -179.816 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 66.7 mt -94.26 126.85 39.76 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.966 -0.561 . . . . 10.0 109.909 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 34' ' ' ILE . 33.4 mtpt -96.84 109.7 22.34 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.01 0.433 . . . . 10.0 110.721 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.4 t -91.98 123.71 44.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.63 -0.713 . . . . 10.0 109.665 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.6 mm -94.06 113.22 28.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 120.984 0.421 . . . . 10.0 110.852 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.6 156.3 33.14 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.81 -0.632 . . . . 10.0 112.087 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -70.15 -12.4 61.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.875 0.369 . . . . 10.0 111.362 -179.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -100.69 22.43 11.94 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.35 0.595 . . . . 10.0 110.052 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.2 m 63.71 45.33 4.58 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 114.814 -1.085 . . . . 10.0 111.822 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.2 p -111.58 138.34 48.24 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.206 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.495 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 16.6 mt-10 -108.81 103.94 13.11 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.152 0.501 . . . . 10.0 109.942 179.425 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.475 ' O ' ' HA ' ' A' ' 25' ' ' LYS . 3.9 mm -91.18 129.91 41.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.443 -179.399 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.456 ' CD2' ' HB3' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -109.36 101.28 10.28 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.437 -0.347 . . . . 10.0 110.067 -179.696 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.23 115.35 27.3 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.2 -0.296 . . . . 10.0 110.2 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -88.06 100.13 12.7 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.469 HG12 HD11 ' A' ' 47' ' ' LEU . 3.0 m -107.45 174.04 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.996 0.427 . . . . 10.0 111.544 -178.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.3 tttt -123.23 146.7 47.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.817 -0.629 . . . . 10.0 109.493 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.496 ' O ' ' HB ' ' A' ' 41' ' ' THR . 49.0 tpp -77.64 76.02 4.18 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.089 0.471 . . . . 10.0 111.569 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.496 ' HB ' ' O ' ' A' ' 40' ' ' MET . 15.3 t 170.12 -25.83 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.466 -0.788 . . . . 10.0 110.0 178.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.419 ' OG1' ' HB2' ' B' ' 366' ' ' ASP . 0.9 OUTLIER -74.49 134.01 42.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.239 179.336 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 31.5 m170 -70.11 143.78 52.27 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.575 -179.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 75.2 mt -69.38 -8.59 47.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 10.0 111.042 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.511 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 37.4 tptt -58.18 -53.99 52.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.527 178.169 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -61.16 -41.74 97.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.525 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.469 HD11 HG12 ' A' ' 38' ' ' VAL . 3.4 mm? -57.97 -41.79 83.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.609 -179.413 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -68.67 -31.98 71.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.403 -0.362 . . . . 10.0 111.315 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.511 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 39.7 mt-10 -75.32 -51.78 12.39 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.751 0.31 . . . . 10.0 111.306 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.0 m -61.33 -33.77 74.16 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.278 0.473 . . . . 10.0 112.278 -179.167 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -63.14 -46.06 89.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.706 0.288 . . . . 10.0 110.778 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.504 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 58.8 m -61.95 -37.23 83.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.093 0.473 . . . . 10.0 110.245 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -61.71 -42.84 99.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.764 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 52.9 ttt85 -69.22 -33.41 73.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.375 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -74.78 -16.42 60.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.708 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.88 30.92 45.66 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.911 -0.661 . . . . 10.0 112.84 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.8 m -137.49 154.53 75.27 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 110.205 -0.295 . . . . 10.0 110.205 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.51 154.64 58.02 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.443 2.095 . . . . 10.0 111.829 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.504 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 3.9 ttt -66.54 157.22 32.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.725 -0.216 . . . . 10.0 110.98 -179.591 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.446 ' N ' ' HG2' ' A' ' 59' ' ' MET . 2.4 t-20 78.02 4.17 2.84 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.633 0.773 . . . . 10.0 111.571 179.036 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.4 p -87.88 -19.98 26.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.076 0.465 . . . . 10.0 109.958 179.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.0 mt -125.77 135.22 51.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.665 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.509 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 29.1 ptt-85 -112.09 138.96 48.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.241 -0.436 . . . . 10.0 109.88 179.202 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -96.19 132.03 42.04 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.9 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.0 mt -115.78 115.69 26.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.005 0.431 . . . . 10.0 111.132 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -128.07 118.57 23.71 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.563 -0.744 . . . . 10.0 109.357 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 61.66 29.97 18.35 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.079 0.466 . . . . 10.0 110.752 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.89 -4.28 75.84 Favored Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.862 -0.608 . . . . 10.0 112.604 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 44.8 mm-40 -102.34 136.79 41.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.576 0.226 . . . . 10.0 110.717 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -82.3 128.71 34.47 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.621 -0.511 . . . . 10.0 109.621 178.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 46.6 mm -70.03 118.84 15.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.229 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -90.11 168.78 11.7 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.295 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.91 -24.83 62.54 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.202 0.525 . . . . 10.0 110.579 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -95.77 24.97 4.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.423 -0.808 . . . . 10.0 111.58 -179.045 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 50.1 m170 -109.32 157.47 18.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.79 0.328 . . . . 10.0 110.837 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.586 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 27.9 p -134.26 160.31 68.97 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.067 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -68.73 -14.22 38.7 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.364 2.042 . . . . 10.0 112.012 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -69.65 -34.11 73.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.882 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.586 ' HG2' ' O ' ' A' ' 76' ' ' THR . 6.3 pt-20 -91.22 168.8 11.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.063 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 17.8 mt 73.01 -48.81 0.69 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.405 0.682 . . . . 10.0 111.432 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.14 58.89 0.33 Allowed Glycine 0 N--CA 1.444 -0.77 0 C-N-CA 120.652 -0.785 . . . . 10.0 112.558 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 43.6 mtt -86.34 120.21 27.44 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 179.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -113.17 178.14 4.38 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.204 0.525 . . . . 10.0 111.534 -178.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.535 ' CD ' ' HZ2' ' A' ' 23' ' ' LYS . 3.6 tp10 -69.01 140.52 54.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.413 -0.812 . . . . 10.0 110.762 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 63.6 mm-40 60.59 32.84 20.46 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.792 -0.64 . . . . 10.0 111.582 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -80.61 146.44 31.2 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.663 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 20.2 t -98.11 132.1 43.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.763 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.437 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 20.3 tt -135.42 149.34 28.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.018 179.61 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -108.95 152.49 24.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.982 0.42 . . . . 10.0 111.382 -179.392 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.8 p -135.22 135.86 51.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.469 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -137.37 157.22 47.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.716 -0.22 . . . . 10.0 110.791 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -80.61 131.36 35.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.581 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.509 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.6 mm-40 -69.47 145.28 52.86 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.879 -179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -63.21 -23.13 67.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.07 -0.514 . . . . 10.0 111.441 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.0 p -76.74 -20.39 56.57 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.908 0.385 . . . . 10.0 111.219 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.67 -11.18 62.42 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.005 -0.617 . . . . 10.0 111.948 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.786 -1.008 . . . . 10.0 111.275 -179.808 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 55.9 t30 . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.775 0.322 . . . . 10.0 110.77 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 358' ' ' ASN . . . . . 0.495 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 59.7 t30 -120.24 124.38 45.53 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 109.364 -0.606 . . . . 10.0 109.364 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 24.5 ptt180 -124.2 128.24 48.92 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.42 0.629 . . . . 10.0 111.321 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -120.66 130.33 24.9 Favored Pre-proline 0 C--N 1.318 -0.791 0 N-CA-C 107.569 -1.271 . . . . 10.0 107.569 177.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -108.79 130.59 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.232 0 C-N-CA 121.948 1.765 . . . . 10.0 113.456 -178.244 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 2.6 mt -117.67 136.44 54.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 113.967 -1.47 . . . . 10.0 109.705 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 60.3 t -113.42 133.01 60.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 N-CA-C 109.109 -0.7 . . . . 10.0 109.109 -179.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 6.3 tp -114.98 144.23 22.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-N 114.628 -1.169 . . . . 10.0 110.948 -176.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 366' ' ' ASP . . . . . 0.419 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 2.0 t70 -110.71 130.11 55.66 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.287 -0.87 . . . . 10.0 112.093 -173.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo . . . . . 0 C--O 1.251 1.152 0 C-N-CA 122.46 2.107 . . . . 10.0 111.488 178.648 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 . . . . . 0 N--CA 1.477 0.881 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 11.6 mm -112.79 123.28 68.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.432 -0.581 . . . . 10.0 109.432 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.7 ttpm? -100.18 113.7 26.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.953 0.406 . . . . 10.0 111.207 -179.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 80.3 mt -101.26 140.07 36.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.803 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.0 mtpt -101.77 110.44 22.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.758 0.313 . . . . 10.0 110.766 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.46 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 7.1 t -88.1 123.48 40.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 108.915 -0.772 . . . . 10.0 108.915 178.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.8 mm -92.82 111.95 25.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 120.956 0.408 . . . . 10.0 111.473 -178.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.26 156.8 29.85 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 111.314 -0.715 . . . . 10.0 111.314 178.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 48.2 tp60 -64.88 -22.18 66.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.886 0.374 . . . . 10.0 110.992 -179.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -93.98 17.52 12.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.962 0.41 . . . . 10.0 110.819 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.2 m 62.98 45.8 5.16 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.721 -0.672 . . . . 10.0 111.415 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.3 128.74 38.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.959 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.456 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 3.6 mp0 -92.34 88.06 6.28 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.513 0.673 . . . . 10.0 110.255 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.46 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 12.7 mm -80.97 128.63 38.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.617 -0.72 . . . . 10.0 111.929 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.4 ' O ' ' HA ' ' B' ' 361' ' ' PRO . 10.1 m170 -103.7 89.82 3.46 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.143 -0.688 . . . . 10.0 109.143 178.758 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -92.61 109.54 20.96 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.774 -0.371 . . . . 10.0 110.86 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -88.48 97.28 10.99 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.4 m -98.34 168.15 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.885 -179.196 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 54.1 tttt -118.43 135.33 54.42 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.261 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 45.3 tpp -80.26 77.46 7.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.088 0.471 . . . . 10.0 110.885 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.8 t 177.95 -37.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.222 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.7 148.79 28.8 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.142 179.436 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 13.5 m80 -68.9 153.46 43.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.597 0.237 . . . . 10.0 110.743 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.436 HD12 ' HB3' ' A' ' 75' ' ' HIS . 34.7 mt -69.31 -15.86 63.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.506 -0.315 . . . . 10.0 111.136 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 36.2 tttp -59.25 -46.67 87.88 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.928 -0.397 . . . . 10.0 109.928 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.53 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.5 tppp? -58.7 -32.04 68.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.559 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -74.62 -39.33 62.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.626 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -62.86 -52.5 62.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.899 -0.592 . . . . 10.0 111.789 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.404 ' HG2' ' H ' ' A' ' 49' ' ' GLU . 3.1 pt-20 -64.4 -31.74 73.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.582 -0.281 . . . . 10.0 111.461 -179.03 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 53.9 m -72.92 -34.95 66.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.754 0.311 . . . . 10.0 110.918 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -65.98 -36.06 82.29 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.933 0.397 . . . . 10.0 110.14 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 56.6 m -61.95 -40.27 94.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.947 -0.569 . . . . 10.0 109.782 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -66.45 -31.94 73.0 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.54 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.418 HH21 ' CG ' ' B' ' 360' ' ' ASP . 16.9 tpt180 -68.48 -39.74 81.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.871 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -85.51 -16.71 38.65 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.476 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.63 37.93 13.02 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.817 -0.706 . . . . 10.0 112.398 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 9.1 m -133.61 155.41 80.57 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 110.224 -0.288 . . . . 10.0 110.224 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -70.03 167.69 24.07 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.251 1.967 . . . . 10.0 111.373 179.005 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.7 ttt -74.19 163.52 27.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.608 0.242 . . . . 10.0 110.572 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.2 t30 74.74 0.58 3.6 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.367 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.3 p -86.56 -46.87 9.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.124 0.488 . . . . 10.0 110.036 179.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.2 mt -99.55 131.02 45.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.866 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.528 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 13.2 ptt180 -110.3 128.71 55.67 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.79 179.148 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -88.5 130.27 35.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.937 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.7 mt -113.81 126.22 54.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.067 0.46 . . . . 10.0 110.397 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -135.62 117.32 15.01 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.624 -0.716 . . . . 10.0 109.926 -179.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 62.74 18.51 10.71 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.761 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.91 -18.73 49.0 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.604 -0.808 . . . . 10.0 112.911 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -98.31 157.77 15.98 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.621 -0.34 . . . . 10.0 110.639 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -96.2 131.26 42.85 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.339 -0.391 . . . . 10.0 110.308 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 48.8 mm -66.68 121.03 15.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.609 -0.723 . . . . 10.0 111.556 -179.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.95 168.26 13.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.57 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -75.67 -18.5 59.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.217 0.532 . . . . 10.0 110.479 179.759 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -96.29 11.44 34.59 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.946 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.436 ' HB3' HD12 ' A' ' 44' ' ' LEU . 2.5 m170 -90.01 145.7 24.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.235 0.541 . . . . 10.0 111.558 -179.13 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 34.9 p -118.07 155.24 51.52 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.539 -0.755 . . . . 10.0 109.172 178.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_exo -68.96 -7.55 21.09 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.518 2.146 . . . . 10.0 112.805 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -86.51 -33.5 20.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.42 -0.354 . . . . 10.0 111.235 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 11.2 pt-20 -85.48 174.91 9.15 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.619 -0.432 . . . . 10.0 110.006 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.42 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 87.6 mt 73.04 -59.46 0.57 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.318 0.647 . . . . 10.0 110.701 -179.285 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 132.07 61.63 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.592 -0.813 . . . . 10.0 113.033 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 49.5 mtt -98.42 133.59 42.59 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.354 -0.239 . . . . 10.0 110.354 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.2 mm-40 -132.62 -176.96 4.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.183 0.516 . . . . 10.0 111.436 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -70.06 140.1 52.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.154 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 63.95 27.62 14.38 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 123.526 0.516 . . . . 10.0 111.231 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -74.07 171.12 14.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.04 0.448 . . . . 10.0 111.397 -179.432 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.5 t -121.12 132.73 69.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.898 -178.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 20.5 tt -138.89 140.88 37.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 110.165 -0.309 . . . . 10.0 110.165 179.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -103.35 156.17 17.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.699 -179.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.4 p -143.27 127.27 14.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.112 0.482 . . . . 10.0 110.219 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -136.66 165.23 26.38 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.971 -0.558 . . . . 10.0 110.039 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -90.38 136.81 32.82 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 110.353 -0.239 . . . . 10.0 110.353 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.528 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.1 mm-40 -67.66 164.94 18.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.709 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -68.64 -26.94 65.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.082 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 34.1 p -74.7 -30.86 61.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.36 0.6 . . . . 10.0 110.769 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.98 20.4 67.89 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.208 -0.757 . . . . 10.0 111.208 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.671 -1.072 . . . . 10.0 111.302 -179.596 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 64.2 t30 . . . . . 0 N--CA 1.482 1.153 0 CA-C-O 121.364 0.602 . . . . 10.0 110.492 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 358' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 42.5 t30 -119.15 123.09 43.53 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.265 -1.013 . . . . 10.0 108.265 179.099 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 359' ' ' ARG . . . . . 0.456 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 13.5 ptt180 -124.14 125.4 44.41 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 120.156 -0.617 . . . . 10.0 111.053 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 360' ' ' ASP . . . . . 0.418 ' CG ' HH21 ' A' ' 54' ' ' ARG . 30.9 t0 -124.13 130.18 24.47 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 107.544 -1.28 . . . . 10.0 107.544 176.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 361' ' ' PRO . . . . . 0.4 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 53.0 Cg_endo -108.18 129.51 0.05 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.516 0 C-N-CA 121.969 1.779 . . . . 10.0 111.848 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 10.6 mt -117.35 136.75 53.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 114.695 -1.139 . . . . 10.0 110.276 -178.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 11.4 t -112.17 135.69 50.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.984 -178.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 364' ' ' ILE . . . . . 0.53 HD11 ' HG3' ' A' ' 46' ' ' LYS . 8.7 tp -113.05 145.19 19.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 114.878 -1.055 . . . . 10.0 111.439 -176.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -114.77 130.81 56.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.847 -1.07 . . . . 10.0 111.94 -175.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo . . . . . 0 C--O 1.244 0.819 0 C-N-CA 123.094 2.529 . . . . 10.0 112.375 -179.718 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 . . . . . 0 N--CA 1.477 0.905 0 N-CA-C 110.162 -0.31 . . . . 10.0 110.162 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.4 mm -109.68 119.17 58.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 109.408 -0.59 . . . . 10.0 109.408 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.437 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 6.8 ttpm? -96.28 108.65 21.17 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.19 0.519 . . . . 10.0 110.835 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.8 mt -98.3 136.58 38.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.573 179.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 78.3 mttt -97.56 112.84 24.54 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.138 0.494 . . . . 10.0 110.596 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.404 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.8 t -91.95 135.24 27.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.153 -179.778 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 32.6 mm -90.72 108.39 19.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.619 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.425 ' HA3' ' OG ' ' A' ' 32' ' ' SER . . . -80.71 150.33 31.03 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.809 -0.71 . . . . 10.0 112.043 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -64.08 -22.67 67.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.846 0.355 . . . . 10.0 111.516 -179.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -96.49 26.73 4.21 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.717 0.294 . . . . 10.0 110.92 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 29.5 m 60.63 45.06 10.76 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.502 0.667 . . . . 10.0 110.864 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.425 ' OG ' ' HA3' ' A' ' 28' ' ' GLY . 3.8 p -106.65 149.48 27.19 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.395 -0.821 . . . . 10.0 110.608 -179.767 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.509 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 28.1 tt0 -108.73 97.34 7.0 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.228 -0.656 . . . . 10.0 109.228 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.404 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 0.8 OUTLIER -86.23 126.24 40.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.658 -178.928 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.8 m170 -101.99 96.79 7.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.114 0.483 . . . . 10.0 109.946 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -89.32 109.98 20.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.923 -0.581 . . . . 10.0 110.425 -179.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -89.72 91.56 8.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.321 179.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.415 ' HA ' ' CG2' ' B' ' 364' ' ' ILE . 5.1 m -100.93 -174.54 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.761 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -135.11 143.85 46.83 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.955 -0.387 . . . . 10.0 109.955 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 60.8 tpp -78.42 60.83 2.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.408 0.623 . . . . 10.0 110.555 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.2 m -161.69 -38.76 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.605 -0.725 . . . . 10.0 109.597 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.59 153.61 38.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.482 -0.781 . . . . 10.0 111.628 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -80.07 151.48 29.86 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.387 -0.824 . . . . 10.0 110.019 179.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.494 ' HA ' HD23 ' A' ' 47' ' ' LEU . 74.7 mt -72.07 -10.63 60.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.743 0.306 . . . . 10.0 110.758 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -59.91 -46.68 88.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.981 178.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.485 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.9 tppp? -62.99 -41.0 99.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.411 -0.813 . . . . 10.0 110.778 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.494 HD23 ' HA ' ' A' ' 44' ' ' LEU . 1.5 mm? -65.07 -41.58 94.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.915 -178.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -58.79 -47.56 84.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.285 -0.416 . . . . 10.0 112.015 -179.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -74.39 -38.22 63.18 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.717 -0.393 . . . . 10.0 111.674 -179.197 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 63.5 m -59.56 -34.01 72.14 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.888 0.375 . . . . 10.0 110.744 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -69.78 -41.66 74.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.332 -0.395 . . . . 10.0 109.937 178.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.563 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 79.4 m -62.1 -43.38 98.95 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.327 -0.397 . . . . 10.0 109.939 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -63.37 -36.38 83.53 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.215 0.531 . . . . 10.0 110.175 179.254 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -65.32 -40.33 93.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.404 179.289 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -77.68 -22.73 50.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.07 -0.513 . . . . 10.0 110.949 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.43 24.96 29.56 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.326 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.5 m -124.07 154.43 68.13 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 110.394 -0.225 . . . . 10.0 110.394 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -61.18 153.05 67.65 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.473 2.116 . . . . 10.0 111.608 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.563 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 17.2 ttt -65.82 152.38 44.51 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 121.232 -0.187 . . . . 10.0 110.889 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.5 t30 82.53 -3.78 1.38 Allowed 'General case' 0 N--CA 1.472 0.644 0 O-C-N 124.175 0.922 . . . . 10.0 111.681 179.09 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.4 p -79.0 -24.35 43.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.202 0.525 . . . . 10.0 110.326 179.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.1 mt -117.82 131.48 56.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.124 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.432 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 16.6 ptt-85 -104.1 138.27 40.84 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.322 179.526 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.415 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 73.4 m-85 -100.41 127.26 46.78 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.139 -0.482 . . . . 10.0 109.924 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt -112.17 117.09 31.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.048 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -117.52 107.19 13.98 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.291 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 59.1 34.29 23.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.092 0.472 . . . . 10.0 111.02 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.61 -3.11 87.31 Favored Glycine 0 CA--C 1.518 0.262 0 CA-C-N 115.849 -0.614 . . . . 10.0 113.103 179.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -106.7 128.51 54.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.871 0.336 . . . . 10.0 110.494 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.415 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 13.9 ptm180 -76.25 126.66 31.39 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.074 0.464 . . . . 10.0 110.532 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.4 mm -66.78 123.6 20.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.577 -0.738 . . . . 10.0 110.953 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -84.74 170.9 12.79 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.674 -0.693 . . . . 10.0 110.787 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.48 5.54 17.46 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.96 -0.564 . . . . 10.0 111.147 -179.641 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -130.32 18.16 5.41 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.708 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.483 ' HB3' HD12 ' A' ' 44' ' ' LEU . 22.3 m170 -88.94 159.46 17.64 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.07 0.462 . . . . 10.0 111.114 -179.55 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.488 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -131.34 153.47 81.65 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.595 -0.729 . . . . 10.0 110.075 179.678 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.2 -17.82 55.08 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.393 2.062 . . . . 10.0 112.325 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -70.68 -36.67 73.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.925 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 76' ' ' THR . 11.2 pt-20 -85.87 167.23 15.34 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.432 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 84.9 mt 73.79 -51.36 0.69 Allowed 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.208 0.603 . . . . 10.0 110.63 -179.01 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 117.02 61.41 0.31 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.006 -0.616 . . . . 10.0 113.022 178.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 44.4 mtt -87.32 125.05 33.99 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.759 0.314 . . . . 10.0 110.311 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.508 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 7.4 mm-40 -123.74 177.6 5.63 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.135 0.493 . . . . 10.0 111.336 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.437 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 21.7 tp10 -70.25 142.09 52.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.706 179.407 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.436 ' HG2' ' HG3' ' A' ' 84' ' ' GLU . 70.2 mm-40 68.23 25.06 7.31 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 123.464 0.477 . . . . 10.0 111.039 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.508 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.1 t70 -76.52 162.16 28.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.523 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 95.4 t -117.17 125.52 73.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.869 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.4 tt -129.4 137.55 56.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.061 -0.518 . . . . 10.0 109.959 179.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -103.49 149.56 24.73 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.898 0.38 . . . . 10.0 111.536 -178.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -132.06 130.89 61.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.835 -0.621 . . . . 10.0 109.808 179.178 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -134.77 157.62 46.28 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.761 0.315 . . . . 10.0 111.138 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -75.4 129.73 37.82 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.679 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.432 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 3.1 mm-40 -79.15 152.65 30.6 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.742 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -77.05 0.15 22.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.707 -0.679 . . . . 10.0 111.433 -178.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.4 p -88.31 -27.86 21.42 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.086 0.469 . . . . 10.0 110.525 179.174 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.09 16.3 80.66 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.674 -179.139 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.945 -0.919 . . . . 10.0 110.965 -179.589 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 29.6 t30 . . . . . 0 N--CA 1.483 1.177 0 CA-C-O 120.458 0.171 . . . . 10.0 110.886 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -120.19 119.83 34.37 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 119.703 -0.799 . . . . 10.0 109.451 178.478 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 359' ' ' ARG . . . . . 0.509 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 18.4 ptt180 -130.01 129.76 44.12 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.377 0.51 . . . . 10.0 112.377 179.06 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 360' ' ' ASP . . . . . 0.41 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 23.8 t70 -121.85 129.96 24.94 Favored Pre-proline 0 C--N 1.316 -0.867 0 N-CA-C 107.31 -1.367 . . . . 10.0 107.31 175.734 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 361' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 71.7 Cg_endo -108.37 129.11 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.107 0 C-N-CA 121.651 1.567 . . . . 10.0 112.581 -179.072 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 7.4 mt -117.84 136.36 55.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 114.182 -1.372 . . . . 10.0 110.735 -177.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 99.3 t -114.28 135.2 54.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 108.509 -0.923 . . . . 10.0 108.509 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 364' ' ' ILE . . . . . 0.485 HD11 ' HG3' ' A' ' 46' ' ' LYS . 8.3 tp -114.16 147.22 17.81 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 114.818 -1.083 . . . . 10.0 112.261 -176.151 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -114.46 129.95 56.69 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.927 -1.033 . . . . 10.0 111.211 -175.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 367' ' ' SEP . . . . . 0.45 ' HA ' ' HD3' ' B' ' 368' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 368' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' B' ' 367' ' ' SEP . 21.8 Cg_exo . . . . . 0 C--O 1.246 0.882 0 C-N-CA 123.142 2.562 . . . . 10.0 111.516 179.257 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 N--CA 1.481 1.08 0 CA-C-O 120.84 0.353 . . . . 10.0 110.624 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.8 mm -122.44 117.05 50.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 179.276 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.56 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.9 ttpm? -93.15 119.49 32.41 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.132 0.491 . . . . 10.0 111.021 -179.066 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 59.2 mt -102.27 142.38 33.59 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.762 -0.654 . . . . 10.0 110.096 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.3 mtpt -100.12 100.91 11.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.958 0.409 . . . . 10.0 110.481 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.598 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.3 t -86.17 118.01 31.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.8 mm -97.18 112.65 29.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.025 0.441 . . . . 10.0 111.511 -178.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.26 160.09 37.89 Favored Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 110.901 -0.88 . . . . 10.0 110.901 178.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -66.74 -19.35 65.73 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.911 0.355 . . . . 10.0 111.354 -179.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.39 27.65 3.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.52 -0.309 . . . . 10.0 111.047 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.0 m 62.28 33.79 16.35 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.51 179.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.58 110.14 22.27 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.459 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.4 ' OE1' ' N ' ' B' ' 357' ' ' ASN . 8.7 mt-10 -91.79 98.94 11.92 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.252 -0.647 . . . . 10.0 109.252 178.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.408 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 5.1 mm -87.04 127.82 40.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.467 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.446 ' ND1' ' HE3' ' A' ' 23' ' ' LYS . 14.7 m-70 -103.46 85.66 2.51 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -89.92 119.12 30.02 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.566 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -90.91 101.41 14.17 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.136 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 m -97.57 172.1 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.777 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.442 ' HD3' ' CB ' ' B' ' 366' ' ' ASP . 77.9 tttt -123.51 141.31 52.13 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.819 -0.437 . . . . 10.0 109.819 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.499 ' SD ' ' HB2' ' A' ' 77' ' ' PRO . 41.4 tpp -78.26 54.23 1.35 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.078 0.466 . . . . 10.0 111.548 -179.344 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 52.7 m -154.64 -45.15 0.09 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.221 179.533 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.443 ' OG1' ' HB2' ' B' ' 366' ' ' ASP . 0.3 OUTLIER -73.32 153.05 40.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.693 179.85 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -79.25 155.82 28.38 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.005 -0.739 . . . . 10.0 109.005 179.202 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 78.3 mt -69.81 -8.22 46.42 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.78 0.324 . . . . 10.0 111.172 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 47.8 tptt -58.98 -49.47 77.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.989 -0.551 . . . . 10.0 109.98 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.48 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.9 tppp? -59.64 -41.55 90.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.34 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.46 -40.22 95.28 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.418 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -63.95 -45.31 89.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.321 -0.4 . . . . 10.0 112.053 -179.217 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -73.7 -39.29 64.46 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.668 -0.413 . . . . 10.0 111.536 -179.026 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.476 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 67.6 m -64.92 -32.47 74.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.825 0.345 . . . . 10.0 111.09 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -65.62 -38.46 89.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.057 0.456 . . . . 10.0 110.391 179.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.507 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 60.2 m -63.01 -36.07 82.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.714 -0.676 . . . . 10.0 110.138 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.476 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 74.2 mt-30 -67.91 -34.18 76.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.802 -0.635 . . . . 10.0 110.515 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -67.43 -38.44 84.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.578 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -80.89 -34.48 33.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.309 -179.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 99.97 37.13 3.98 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.69 -0.767 . . . . 10.0 112.168 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.448 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 2.5 m -137.1 155.82 75.89 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 109.984 -0.376 . . . . 10.0 109.984 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -69.17 155.19 68.65 Favored 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.18 1.92 . . . . 10.0 111.382 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.507 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 11.9 ttt -64.09 158.02 23.87 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 121.097 -0.241 . . . . 10.0 111.176 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.6 t30 81.03 -0.48 1.76 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.75 0.82 . . . . 10.0 111.461 179.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 57.1 p -86.25 -29.5 23.06 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.17 0.509 . . . . 10.0 110.441 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 25.0 mt -119.06 140.47 50.01 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.795 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.479 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 21.4 ptt-85 -117.44 141.59 48.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.159 179.225 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.467 ' HB3' HD11 ' A' ' 88' ' ' ILE . 93.4 m-85 -96.83 129.72 44.22 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.138 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt -107.58 116.07 31.29 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.963 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -124.68 113.31 17.82 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 61.56 32.55 18.64 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 123.484 0.49 . . . . 10.0 110.964 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.67 -13.79 57.61 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.018 -0.61 . . . . 10.0 113.104 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -100.27 147.35 25.85 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.913 0.387 . . . . 10.0 110.651 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -89.33 126.69 35.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.004 0.43 . . . . 10.0 110.523 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 42.9 mm -63.77 125.26 20.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.568 -0.742 . . . . 10.0 111.191 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.64 -179.25 7.27 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.946 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 1.5 m-20 -88.92 -2.6 58.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.49 -0.323 . . . . 10.0 111.338 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -119.37 12.07 12.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.683 0.278 . . . . 10.0 111.142 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -84.16 153.89 23.42 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.112 0.482 . . . . 10.0 111.722 -179.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.447 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 35.6 p -124.73 157.48 65.77 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.55 -0.75 . . . . 10.0 109.636 178.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.499 ' HB2' ' SD ' ' A' ' 40' ' ' MET . 14.9 Cg_exo -69.23 -12.54 34.15 Favored 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 122.382 2.055 . . . . 10.0 112.692 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -77.07 -41.24 43.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.641 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.6 pt-20 -77.94 160.17 28.39 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 179.243 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 33.9 mt 73.69 -43.65 0.55 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.506 0.504 . . . . 10.0 110.379 -178.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 105.18 74.72 0.96 Allowed Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.965 -0.636 . . . . 10.0 113.55 178.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 36.6 mtt -96.74 131.74 43.15 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.688 -0.486 . . . . 10.0 109.688 178.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.547 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.3 mm-40 -129.9 179.01 6.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.939 0.4 . . . . 10.0 111.47 -179.492 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.56 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 20.7 tp10 -69.0 142.41 54.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.587 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 66.39 19.89 10.96 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 123.687 0.617 . . . . 10.0 111.249 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.547 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.8 OUTLIER -69.78 138.73 52.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.29 -0.413 . . . . 10.0 110.144 179.96 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.7 t -93.82 120.03 42.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.859 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.598 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 18.3 tt -133.28 139.48 49.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 179.387 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -112.15 154.28 25.73 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.901 0.382 . . . . 10.0 111.114 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.7 p -128.53 136.21 60.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.802 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -135.59 157.14 47.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.583 0.23 . . . . 10.0 110.823 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -74.41 136.61 42.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.553 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.479 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 6.1 mm-40 -71.39 161.54 30.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.905 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -65.37 -34.04 77.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.827 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.3 p -69.96 -30.2 67.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.002 0.43 . . . . 10.0 110.704 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.27 3.42 87.14 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 121.048 -0.596 . . . . 10.0 111.933 -179.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.961 0 CA-C-O 118.745 -1.031 . . . . 10.0 111.13 -179.889 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 357' ' ' ASN . . . . . 0.4 ' N ' ' OE1' ' A' ' 33' ' ' GLU . 4.8 p-10 . . . . . 0 N--CA 1.483 1.192 0 N-CA-C 111.395 0.146 . . . . 10.0 111.395 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -119.88 123.76 44.39 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 109.033 -0.729 . . . . 10.0 109.033 179.049 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -125.49 126.47 44.94 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.963 0.727 . . . . 10.0 112.963 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 360' ' ' ASP . . . . . 0.45 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 39.2 t70 -126.67 127.42 24.49 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 175.538 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 361' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 61.4 Cg_endo -110.92 126.03 0.03 OUTLIER 'Trans proline' 0 CA--C 1.536 0.593 0 C-N-CA 121.926 1.75 . . . . 10.0 113.414 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 3.4 mt -122.97 136.73 58.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 114.908 -1.042 . . . . 10.0 110.409 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 43.4 t -113.54 135.66 52.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.014 0.435 . . . . 10.0 110.006 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 364' ' ' ILE . . . . . 0.48 HD11 ' HG3' ' A' ' 46' ' ' LYS . 7.1 tp -112.33 145.25 18.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.242 -0.89 . . . . 10.0 111.428 -176.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 365' ' ' SEP . . . . . 0.403 ' P ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 366' ' ' ASP . . . . . 0.443 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 7.3 t70 -114.56 132.45 56.33 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.252 -1.34 . . . . 10.0 111.046 -176.787 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo . . . . . 0 C--O 1.251 1.172 0 C-N-CA 122.973 2.448 . . . . 10.0 112.164 -179.529 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 109.709 -0.478 . . . . 10.0 109.709 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.502 ' O ' HG22 ' A' ' 38' ' ' VAL . 34.1 mm -73.35 112.25 9.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.954 0.407 . . . . 10.0 110.553 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.507 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -97.18 101.11 12.61 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.102 0.477 . . . . 10.0 110.114 179.601 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 69.9 mt -82.89 157.54 23.04 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.738 -0.664 . . . . 10.0 110.37 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 34' ' ' ILE . 77.8 tttt -120.94 109.03 14.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.938 0.399 . . . . 10.0 110.675 179.437 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.482 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 3.2 t -92.23 128.05 44.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 179.108 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.1 mm -107.22 122.44 61.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.897 0.379 . . . . 10.0 111.068 -179.44 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -100.78 167.85 20.08 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.756 179.129 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -65.74 -16.14 63.5 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.231 0.538 . . . . 10.0 110.994 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.2 p-10 -92.24 18.41 8.28 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.254 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.2 m 58.08 42.78 21.88 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.413 0.625 . . . . 10.0 110.96 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -90.75 149.32 22.06 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.322 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.518 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 42.5 mt-10 -116.91 86.95 2.6 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.249 -0.649 . . . . 10.0 109.249 178.189 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.482 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 44.2 mm -79.04 118.69 26.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.151 -179.414 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 20.6 m170 -102.16 89.29 3.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.947 -0.76 . . . . 10.0 108.947 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -92.03 116.0 28.55 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.854 -178.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -90.44 97.88 11.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.035 -0.529 . . . . 10.0 109.587 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.502 HG22 ' O ' ' A' ' 22' ' ' ILE . 2.8 m -100.77 170.42 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.61 -179.488 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.1 tttt -122.33 141.07 51.93 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.404 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 62.3 tpp -79.37 75.14 5.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.559 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -176.92 -41.8 0.01 OUTLIER 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.383 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.592 ' OG1' ' HB2' ' B' ' 366' ' ' ASP . 0.2 OUTLIER -76.93 147.49 36.93 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.764 179.772 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.7 m80 -75.61 153.37 37.33 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 53.6 mt -69.93 -4.97 22.96 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.752 0.31 . . . . 10.0 111.324 -179.406 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 46.2 tptt -61.36 -48.79 79.66 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.536 ' HG3' HD11 ' B' ' 364' ' ' ILE . 4.2 tppp? -62.91 -35.23 79.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.276 -0.874 . . . . 10.0 110.256 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.77 -46.97 70.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.683 -0.69 . . . . 10.0 111.031 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -60.57 -44.16 96.49 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.998 -0.546 . . . . 10.0 112.11 -179.089 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -70.81 -41.93 70.92 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.97 -0.292 . . . . 10.0 111.655 -178.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.9 m -64.47 -32.47 74.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.705 0.288 . . . . 10.0 111.222 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -68.77 -35.02 76.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.848 0.356 . . . . 10.0 110.24 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.492 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 85.6 m -62.37 -40.02 95.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.181 0.515 . . . . 10.0 109.927 179.211 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -67.36 -30.73 70.61 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.364 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -68.27 -30.0 68.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.221 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -98.48 -4.95 33.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.319 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.63 36.88 62.03 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.878 -0.677 . . . . 10.0 112.54 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 13.4 m -130.5 152.53 80.49 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 110.067 -0.346 . . . . 10.0 110.067 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -69.82 158.16 57.81 Favored 'Trans proline' 0 N--CA 1.466 -0.13 0 C-N-CA 122.256 1.971 . . . . 10.0 111.443 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.492 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 12.0 ttt -66.74 157.65 32.25 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.959 -0.296 . . . . 10.0 110.348 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.9 t30 79.06 -5.88 1.95 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.483 0.713 . . . . 10.0 111.46 179.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.4 p -81.72 -24.16 36.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.855 0.359 . . . . 10.0 110.832 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 79.2 mt -119.02 143.36 47.12 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.907 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.505 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 16.5 ptt-85 -116.18 128.14 55.38 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.172 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -90.8 128.31 36.66 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.05 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.7 mt -111.01 131.22 55.23 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.62 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -143.03 117.41 9.64 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.56 -0.745 . . . . 10.0 109.97 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 61.07 29.66 19.05 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.782 -0.645 . . . . 10.0 111.883 179.601 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.41 -4.77 85.89 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.71 -0.757 . . . . 10.0 112.784 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -112.78 156.2 23.27 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.187 -0.301 . . . . 10.0 110.187 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -95.66 134.96 37.96 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.072 0.463 . . . . 10.0 110.679 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 37.3 mm -71.79 115.88 12.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.478 -0.783 . . . . 10.0 110.321 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.41 167.05 21.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.169 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.59 11.17 2.18 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.765 -178.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -133.56 11.96 4.09 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.107 0.479 . . . . 10.0 110.325 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -81.93 151.7 27.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.521 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 31.9 p -125.02 153.46 71.27 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.003 179.18 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -66.96 -12.51 36.39 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 122.461 2.107 . . . . 10.0 112.454 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -75.8 -35.82 59.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.706 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 76' ' ' THR . 9.9 pt-20 -91.25 170.26 10.15 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.827 -0.434 . . . . 10.0 109.827 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mt 72.63 -49.79 0.7 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.261 0.625 . . . . 10.0 110.999 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.82 76.26 0.59 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 121.022 -0.608 . . . . 10.0 112.496 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 34.9 mtt -106.52 123.77 48.59 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.997 -0.372 . . . . 10.0 109.997 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.547 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 5.1 mm-40 -122.17 178.87 4.74 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.307 0.575 . . . . 10.0 112.013 -179.298 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.507 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 28.3 tp10 -67.7 137.58 55.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.462 -0.79 . . . . 10.0 109.945 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 65.3 27.79 11.99 Favored 'General case' 0 N--CA 1.464 0.249 0 O-C-N 123.61 0.569 . . . . 10.0 111.112 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.547 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.6 t0 -77.0 142.08 40.08 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.305 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 29.6 t -91.45 120.88 41.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.055 -0.521 . . . . 10.0 111.37 -179.22 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 15.3 tt -129.49 142.78 43.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 108.954 -0.758 . . . . 10.0 108.954 178.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -119.14 153.61 34.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.029 0.442 . . . . 10.0 111.449 -178.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.9 p -135.73 133.84 51.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.851 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -134.04 164.3 27.64 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.617 -0.265 . . . . 10.0 110.677 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -72.87 134.31 44.78 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.481 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.505 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 0.7 OUTLIER -72.08 164.48 26.08 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.231 179.931 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -68.06 -36.45 79.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.502 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.0 p -71.18 -30.26 66.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.11 0.481 . . . . 10.0 111.008 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.73 5.4 89.88 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.579 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.829 -0.984 . . . . 10.0 111.012 -179.802 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 22.0 m120 . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.512 0.196 . . . . 10.0 111.228 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 358' ' ' ASN . . . . . 0.518 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 54.5 t30 -119.6 119.62 34.31 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 177.47 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 359' ' ' ARG . . . . . 0.5 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 14.1 ptt85 -126.59 129.58 48.82 Favored 'General case' 0 CA--C 1.506 -0.722 0 C-N-CA 119.857 -0.737 . . . . 10.0 112.094 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 360' ' ' ASP . . . . . 0.435 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 31.7 t70 -121.8 132.48 24.23 Favored Pre-proline 0 C--N 1.311 -1.09 0 N-CA-C 107.298 -1.371 . . . . 10.0 107.298 177.665 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 361' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 58.5 Cg_endo -106.81 129.69 0.05 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.438 0 C-N-CA 121.914 1.742 . . . . 10.0 112.328 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 9.5 mt -118.97 136.92 54.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 113.884 -1.507 . . . . 10.0 110.774 -178.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 52.6 t -113.39 135.07 54.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.295 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 364' ' ' ILE . . . . . 0.536 HD11 ' HG3' ' A' ' 46' ' ' LYS . 9.3 tp -112.55 144.66 19.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 114.951 -1.022 . . . . 10.0 110.546 -176.476 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 366' ' ' ASP . . . . . 0.592 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 0.2 OUTLIER -116.47 132.28 56.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 113.853 -1.521 . . . . 10.0 112.601 -174.791 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 368' ' ' PRO . . . . . 0.514 ' HD3' ' O ' ' B' ' 366' ' ' ASP . 7.2 Cg_endo . . . . . 0 C--O 1.246 0.917 0 C-N-CA 122.812 2.341 . . . . 10.0 111.925 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 110.178 -0.304 . . . . 10.0 110.178 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.7 mm -112.82 117.51 55.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.778 -0.453 . . . . 10.0 109.778 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.7 OUTLIER -97.06 102.95 14.84 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.138 0.494 . . . . 10.0 110.796 -179.463 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 45.3 mt -82.79 146.96 28.67 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.872 -0.604 . . . . 10.0 109.808 179.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.7 ttpt -110.95 99.54 8.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.011 0.434 . . . . 10.0 109.986 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.456 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.9 t -78.16 133.05 31.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.929 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.434 ' HB ' ' HG2' ' A' ' 89' ' ' GLU . 15.4 mm -92.1 110.29 22.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.902 -179.345 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.441 ' HA3' ' OG ' ' A' ' 32' ' ' SER . . . -83.0 160.49 38.8 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.625 -0.798 . . . . 10.0 112.053 179.208 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -64.02 -31.97 73.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.791 0.329 . . . . 10.0 111.334 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -92.03 25.85 2.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.055 0.455 . . . . 10.0 110.468 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.1 m 63.4 32.95 14.17 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.502 -0.772 . . . . 10.0 111.003 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.441 ' OG ' ' HA3' ' A' ' 28' ' ' GLY . 0.3 OUTLIER -84.9 129.94 34.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.526 -0.761 . . . . 10.0 109.989 179.397 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -97.99 94.83 7.08 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.591 -0.522 . . . . 10.0 109.591 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.456 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 4.6 mm -77.9 121.75 31.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.209 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.6 m170 -101.97 89.24 3.57 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.276 -0.42 . . . . 10.0 109.88 -179.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.413 ' CD2' HD12 ' B' ' 362' ' ' ILE . 0.1 OUTLIER -96.29 118.48 32.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.296 -179.663 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -91.57 102.02 14.67 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.387 -0.369 . . . . 10.0 110.174 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.2 m -100.4 170.94 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.587 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -123.16 135.44 54.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.063 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.412 ' O ' ' HB ' ' A' ' 41' ' ' THR . 60.8 tpp -75.49 74.39 2.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.038 -179.369 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.412 ' HB ' ' O ' ' A' ' 40' ' ' MET . 15.0 t 178.25 -30.96 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.481 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.68 153.27 22.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.895 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -75.78 150.47 37.75 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.114 179.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 34.8 mt -70.0 -9.96 56.99 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.327 -0.397 . . . . 10.0 111.494 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.9 tptt -59.78 -47.18 86.74 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 178.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.47 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.6 tppp? -60.49 -29.74 69.26 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.65 -0.705 . . . . 10.0 110.59 179.749 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 47' ' ' LEU . 3.8 mm? -79.66 -41.07 27.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.229 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -65.56 -35.36 80.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.268 -0.424 . . . . 10.0 111.111 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.418 ' OE2' ' HG3' ' A' ' 59' ' ' MET . 2.6 mm-40 -71.38 -43.85 66.09 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.103 -179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.3 p -66.57 -37.8 85.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.685 -178.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -59.86 -45.13 93.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.698 0.285 . . . . 10.0 110.454 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.448 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.3 m -60.45 -42.63 96.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.049 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -63.68 -38.45 91.15 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.45 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 -65.38 -36.74 84.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.398 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -76.04 -20.59 57.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.969 -0.559 . . . . 10.0 110.375 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 86.53 26.99 31.13 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.787 -0.642 . . . . 10.0 112.525 179.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.2 m -131.93 158.82 74.44 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 110.453 -0.203 . . . . 10.0 110.453 -179.482 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.23 166.01 18.08 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.452 2.101 . . . . 10.0 112.02 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.448 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 0.2 OUTLIER -72.2 159.39 34.19 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.907 -179.621 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 t30 69.31 13.81 8.52 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.328 0.651 . . . . 10.0 111.49 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 38.9 p -89.2 -22.69 22.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.255 0.55 . . . . 10.0 109.776 178.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 mt -127.7 142.24 51.38 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.482 -0.781 . . . . 10.0 110.591 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.7 ptt-85 -112.05 130.65 55.8 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.013 -0.539 . . . . 10.0 110.024 179.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.491 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 98.0 m-85 -90.65 131.99 36.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.439 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 93.7 mt -113.97 120.11 39.53 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.14 0.495 . . . . 10.0 111.03 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -127.24 112.73 15.44 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.554 -0.906 . . . . 10.0 108.554 179.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 65.65 25.6 11.56 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.089 0.471 . . . . 10.0 110.265 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.92 -14.77 62.45 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.753 -0.658 . . . . 10.0 112.749 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -98.85 148.07 24.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.776 0.322 . . . . 10.0 110.809 -179.157 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.491 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 14.2 ptm180 -85.3 132.19 34.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.964 0.411 . . . . 10.0 110.519 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 41.8 mm -71.24 127.1 32.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.224 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.3 -173.7 3.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.647 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -93.22 -33.36 14.01 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.035 0.445 . . . . 10.0 110.698 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -90.3 4.91 49.34 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.779 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -73.57 147.11 44.21 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.637 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.561 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -124.97 151.22 68.51 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.876 179.479 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -62.65 -15.86 49.06 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.527 2.151 . . . . 10.0 112.413 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -64.92 -41.92 95.14 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.285 179.534 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 76' ' ' THR . 7.7 pt-20 -89.11 171.67 9.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.806 -0.634 . . . . 10.0 109.599 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 18.3 mt 73.23 -49.49 0.69 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.689 0.618 . . . . 10.0 111.139 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.39 76.57 0.83 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 121.101 -0.571 . . . . 10.0 112.27 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 43.9 mtt -106.43 125.67 51.29 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.718 0.294 . . . . 10.0 110.38 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.502 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.2 mm-40 -124.75 178.61 5.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.04 0.448 . . . . 10.0 111.235 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.477 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 19.2 tp10 -67.86 138.67 56.25 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.476 179.755 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 64.51 26.34 13.37 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 123.614 0.571 . . . . 10.0 111.429 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.502 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -71.17 155.6 40.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.421 179.919 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 57.3 t -99.15 120.82 49.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.135 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 11.4 tt -136.45 136.59 48.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.225 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.434 ' HG2' ' HB ' ' A' ' 27' ' ' ILE . 60.7 mt-10 -113.07 159.25 19.38 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.795 0.331 . . . . 10.0 111.081 -179.298 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.3 p -142.16 131.19 22.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.425 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -131.16 158.69 39.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.402 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -71.24 138.0 49.09 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.82 0.343 . . . . 10.0 110.937 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -75.08 160.78 30.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.857 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -64.9 -42.65 94.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.991 -0.549 . . . . 10.0 110.313 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.97 -40.71 96.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.571 -0.74 . . . . 10.0 111.5 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 99.8 -16.23 58.78 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.825 -0.702 . . . . 10.0 112.458 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.001 0 CA-C-O 119.174 -0.792 . . . . 10.0 111.551 -179.946 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 65.4 t30 . . . . . 0 N--CA 1.487 1.413 0 CA-C-O 121.028 0.442 . . . . 10.0 110.79 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -120.88 121.35 37.9 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.291 -1.003 . . . . 10.0 108.291 178.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 23.9 ptt180 -127.51 130.14 48.65 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 112.454 0.538 . . . . 10.0 112.454 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 360' ' ' ASP . . . . . 0.45 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 31.0 t70 -120.12 128.79 25.66 Favored Pre-proline 0 C--N 1.317 -0.842 0 N-CA-C 105.632 -1.988 . . . . 10.0 105.632 175.524 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 361' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 48.8 Cg_endo -108.64 127.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.237 0 C-N-CA 121.542 1.494 . . . . 10.0 113.688 -177.754 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 362' ' ' ILE . . . . . 0.413 HD12 ' CD2' ' A' ' 36' ' ' PHE . 1.7 mt -121.19 134.54 64.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 114.147 -1.388 . . . . 10.0 110.182 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 77.8 t -114.68 136.43 51.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.18 -0.674 . . . . 10.0 109.18 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 364' ' ' ILE . . . . . 0.47 HD11 ' HG3' ' A' ' 46' ' ' LYS . 7.9 tp -111.92 148.26 15.21 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-N 114.766 -1.107 . . . . 10.0 111.316 -176.278 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -112.6 130.88 55.87 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.896 -1.047 . . . . 10.0 111.705 -174.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 367' ' ' SEP . . . . . 0.452 ' HA ' ' HD3' ' B' ' 368' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 368' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' B' ' 367' ' ' SEP . 19.3 Cg_exo . . . . . 0 C--O 1.249 1.045 0 C-N-CA 122.835 2.357 . . . . 10.0 111.496 179.069 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 . . . . . 0 N--CA 1.479 1.021 0 CA-C-O 120.692 0.282 . . . . 10.0 110.271 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.0 mm -122.78 108.4 21.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.504 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.7 OUTLIER -94.82 106.17 18.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.218 0.532 . . . . 10.0 110.677 -179.667 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 30.5 mt -90.76 146.92 23.58 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.231 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.9 mtpt -109.44 105.51 14.89 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.932 -0.395 . . . . 10.0 109.932 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.501 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.5 t -86.7 131.4 34.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.739 179.627 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.5 mm -84.83 104.41 12.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.278 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -72.25 152.13 47.87 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.82 -0.705 . . . . 10.0 112.172 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -61.2 -28.97 69.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.823 0.345 . . . . 10.0 110.981 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -96.14 23.94 6.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.754 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 m 64.77 34.41 9.5 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.089 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.2 p -92.47 142.5 27.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.475 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.436 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 24.4 mt-10 -98.12 102.34 14.06 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.947 -0.39 . . . . 10.0 109.947 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.501 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 9.1 mm -87.49 117.04 30.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.332 -0.395 . . . . 10.0 110.331 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -97.03 92.62 6.16 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.856 -0.424 . . . . 10.0 109.856 179.553 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.34 108.03 20.48 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.993 -0.373 . . . . 10.0 109.993 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -88.28 102.26 14.66 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.795 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -101.84 167.51 2.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.119 -0.492 . . . . 10.0 111.091 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 67.6 tttt -115.82 133.06 56.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.004 -0.544 . . . . 10.0 109.559 179.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.508 ' O ' ' HB ' ' A' ' 41' ' ' THR . 59.5 tpp -75.47 80.33 2.51 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.363 -0.38 . . . . 10.0 111.127 -179.218 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.508 ' HB ' ' O ' ' A' ' 40' ' ' MET . 14.7 t 172.04 -27.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.371 179.195 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.7 150.69 26.59 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.861 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.3 m80 -71.09 144.89 50.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.363 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.434 ' HA ' HD23 ' A' ' 47' ' ' LEU . 19.0 mt -67.71 -12.8 61.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.966 0.412 . . . . 10.0 110.293 179.685 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.8 tptt -57.91 -47.93 81.39 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.794 178.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.481 ' HZ3' ' P ' ' B' ' 365' ' ' SEP . 4.9 tppp? -62.57 -33.56 75.2 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.178 -0.919 . . . . 10.0 110.708 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' A' ' 44' ' ' LEU . 3.3 mm? -71.33 -37.48 71.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.873 -179.629 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -68.87 -46.6 68.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.773 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.433 ' OE1' ' HA ' ' A' ' 46' ' ' LYS . 14.8 pt-20 -66.68 -43.41 84.55 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.586 0.217 . . . . 10.0 111.586 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.439 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 19.3 m -64.15 -33.47 75.85 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.809 0.3 . . . . 10.0 111.809 -179.164 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -65.06 -42.7 93.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.791 0.329 . . . . 10.0 110.298 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.428 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 39.6 m -61.81 -39.46 91.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.183 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.439 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.4 mt-30 -63.68 -36.92 85.42 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.359 179.492 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -67.38 -37.51 83.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.546 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -79.67 -13.74 59.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.943 -0.571 . . . . 10.0 111.003 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.59 27.92 56.18 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.254 -0.498 . . . . 10.0 112.687 179.478 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.5 m -129.25 151.27 77.49 Favored Pre-proline 0 C--N 1.328 -0.365 0 O-C-N 122.663 -0.316 . . . . 10.0 110.698 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.84 151.73 75.18 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.504 2.136 . . . . 10.0 111.678 179.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.428 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 19.4 ttt -63.81 159.24 19.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.495 -0.321 . . . . 10.0 111.058 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 78.18 4.07 2.77 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.662 0.785 . . . . 10.0 111.751 179.104 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.3 p -92.43 -20.21 21.25 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.874 0.369 . . . . 10.0 111.017 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.1 mt -116.75 136.54 52.88 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.279 -0.418 . . . . 10.0 111.245 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.442 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 28.0 ptt-85 -105.91 131.49 53.15 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.909 179.152 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -99.13 119.56 38.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.833 -0.621 . . . . 10.0 109.777 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.7 mt -108.73 114.89 29.06 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.239 0.542 . . . . 10.0 111.385 -178.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -123.18 118.8 28.47 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.368 -0.975 . . . . 10.0 108.368 178.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 64.66 20.16 12.05 Favored 'General case' 0 N--CA 1.464 0.231 0 O-C-N 123.544 0.527 . . . . 10.0 110.342 -178.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.93 -13.12 68.1 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 115.755 -0.657 . . . . 10.0 112.719 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -98.17 150.84 21.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.822 0.344 . . . . 10.0 111.016 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 70' ' ' ARG . 11.7 ptm180 -88.97 124.73 34.53 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.432 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.1 mm -66.04 126.73 25.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.614 -0.721 . . . . 10.0 111.022 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -84.15 -179.88 7.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.621 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.21 -5.94 57.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.901 0.381 . . . . 10.0 111.099 -179.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -113.38 14.7 19.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.995 0.426 . . . . 10.0 110.666 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 20.1 m170 -87.16 158.31 19.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.397 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.548 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 10.6 p -134.13 154.71 80.26 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.435 -0.802 . . . . 10.0 109.399 178.77 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.02 -9.59 25.57 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.352 2.035 . . . . 10.0 112.121 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -71.6 -34.19 69.66 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.6 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.548 ' HG2' ' O ' ' A' ' 76' ' ' THR . 5.5 pt-20 -92.78 171.99 8.63 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.006 -0.368 . . . . 10.0 110.006 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.7 mt 73.13 -44.45 0.59 Allowed 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.829 0.706 . . . . 10.0 111.051 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 107.87 60.53 0.56 Allowed Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 121.228 -0.511 . . . . 10.0 111.96 179.601 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 47.9 mtt -87.63 126.62 35.06 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.031 -0.359 . . . . 10.0 110.031 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.466 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 18.0 mm-40 -130.51 178.59 6.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.335 0.588 . . . . 10.0 112.136 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.504 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 20.3 tp10 -67.85 137.69 55.5 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.323 -0.853 . . . . 10.0 110.333 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 5.9 mm-40 69.46 26.64 5.13 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.615 0.572 . . . . 10.0 111.607 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.466 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.3 OUTLIER -80.98 146.87 30.49 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.956 -0.387 . . . . 10.0 109.956 179.343 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 98.5 t -100.64 127.67 53.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.206 -0.452 . . . . 10.0 111.0 -179.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.4 tt -132.2 146.63 32.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.654 -0.498 . . . . 10.0 109.654 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -110.34 152.22 26.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.848 0.356 . . . . 10.0 111.48 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 10.6 p -141.12 130.0 24.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.932 179.088 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -135.62 164.29 28.17 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.493 -0.322 . . . . 10.0 110.385 -179.523 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -83.4 132.07 35.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.771 0.319 . . . . 10.0 110.584 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.442 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.8 mm-40 -72.72 156.12 39.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.013 -0.54 . . . . 10.0 111.55 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -70.22 -22.0 62.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.492 -0.776 . . . . 10.0 111.273 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.9 p -77.34 -19.5 56.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.933 0.397 . . . . 10.0 111.241 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 74.19 10.71 81.73 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.741 -0.742 . . . . 10.0 111.642 -179.384 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.93 0 CA-C-O 118.65 -1.083 . . . . 10.0 111.202 -179.709 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 64.7 t30 . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 121.046 0.45 . . . . 10.0 110.76 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 358' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 52.8 t30 -119.15 121.42 39.71 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 108.189 -1.041 . . . . 10.0 108.189 178.491 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 359' ' ' ARG . . . . . 0.417 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 24.9 ptt180 -128.73 130.22 46.81 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.642 0.608 . . . . 10.0 112.642 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 360' ' ' ASP . . . . . 0.469 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 32.9 t70 -119.87 131.49 24.39 Favored Pre-proline 0 C--N 1.318 -0.769 0 N-CA-C 107.018 -1.475 . . . . 10.0 107.018 175.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 361' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 68.5 Cg_endo -109.63 128.95 0.04 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 121.775 1.65 . . . . 10.0 113.911 -178.109 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 3.0 mt -118.1 135.72 57.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 114.316 -1.311 . . . . 10.0 110.1 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 59.0 t -114.68 136.61 50.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 108.889 -0.782 . . . . 10.0 108.889 -179.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 364' ' ' ILE . . . . . 0.46 HD11 ' HG3' ' A' ' 46' ' ' LYS . 6.4 tp -111.85 145.11 18.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 115.354 -0.839 . . . . 10.0 112.149 -175.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 365' ' ' SEP . . . . . 0.481 ' P ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -111.85 129.64 56.09 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.847 -1.07 . . . . 10.0 111.707 -174.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_exo . . . . . 0 C--O 1.245 0.833 0 C-N-CA 122.956 2.438 . . . . 10.0 111.366 179.558 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 . . . . . 0 N--CA 1.479 1.0 0 CA-C-O 120.714 0.292 . . . . 10.0 110.517 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 32.4 mm -105.81 126.62 61.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.124 -0.489 . . . . 10.0 109.774 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.427 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.4 ttpm? -99.56 97.74 8.69 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.088 0.471 . . . . 10.0 110.546 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 69.5 mt -84.77 144.84 28.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.334 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.5 mtpt -102.53 107.78 18.86 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.932 0.396 . . . . 10.0 110.696 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.43 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 3.0 t -91.05 122.07 42.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 109.078 -0.712 . . . . 10.0 109.078 178.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 39.1 mm -91.15 108.59 20.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 120.933 0.397 . . . . 10.0 111.158 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.97 158.03 49.28 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.767 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -63.71 -22.09 66.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.63 0.252 . . . . 10.0 111.556 -178.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -103.41 28.63 6.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.794 0.33 . . . . 10.0 111.42 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.7 m 65.69 27.53 11.29 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.693 -0.685 . . . . 10.0 112.243 178.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.29 125.8 35.25 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.558 -0.534 . . . . 10.0 109.558 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -97.5 102.54 14.33 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.19 0.519 . . . . 10.0 110.627 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.43 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 2.9 mm -89.67 129.83 39.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.522 -179.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.2 m170 -103.7 94.82 5.65 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -91.09 116.02 28.48 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.371 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -86.56 99.65 11.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.179 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.458 HG12 HD11 ' A' ' 47' ' ' LEU . 3.4 m -104.06 171.48 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.936 -179.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 49.5 tttm -127.41 140.02 52.44 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.493 ' SD ' ' HB2' ' A' ' 77' ' ' PRO . 43.9 tpp -75.55 63.68 1.55 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.226 0.536 . . . . 10.0 110.609 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.9 m -161.42 -40.14 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.676 -0.693 . . . . 10.0 109.663 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.2 163.36 27.14 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.32 -0.854 . . . . 10.0 111.983 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -90.47 153.62 20.25 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.182 -0.917 . . . . 10.0 109.768 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.5 mt -72.72 -10.6 59.99 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.163 -0.215 . . . . 10.0 111.146 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 30.8 tptt -60.36 -47.31 86.63 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.281 -0.637 . . . . 10.0 109.281 177.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -62.92 -37.2 86.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.144 -0.935 . . . . 10.0 110.486 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.458 HD11 HG12 ' A' ' 38' ' ' VAL . 3.3 mm? -69.14 -45.31 70.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.319 -179.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -60.01 -47.15 87.02 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.222 -0.445 . . . . 10.0 112.063 -179.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -69.27 -37.69 78.02 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 121.051 -0.259 . . . . 10.0 111.584 -178.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.452 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 45.8 m -66.09 -35.65 81.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.852 0.358 . . . . 10.0 111.391 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -66.65 -35.49 80.29 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.495 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 64.5 m -63.86 -35.24 79.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.953 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.452 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 64.2 mt-30 -71.02 -33.71 70.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.178 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.64 -32.99 74.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.599 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -92.15 -29.29 16.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.264 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 97.1 33.08 6.14 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 120.741 -0.742 . . . . 10.0 112.442 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.8 m -128.39 156.96 76.09 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 110.262 -0.273 . . . . 10.0 110.262 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -68.87 156.54 65.08 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.125 1.884 . . . . 10.0 111.197 179.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.495 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 12.1 ttt -67.02 156.43 36.05 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.962 -0.295 . . . . 10.0 110.38 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.4 t30 79.78 -0.27 2.14 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 123.932 0.77 . . . . 10.0 111.697 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 76.0 p -85.89 -27.84 24.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.141 0.496 . . . . 10.0 110.089 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 63.1 mt -112.31 129.83 56.16 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.744 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.474 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.6 ptt-85 -100.86 129.97 46.81 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.798 179.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -96.82 117.86 32.0 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.5 mt -103.66 124.55 49.04 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.336 0.588 . . . . 10.0 111.128 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -127.51 105.38 8.46 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.186 -0.915 . . . . 10.0 109.227 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 65.54 25.13 11.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.459 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.98 -11.37 65.98 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.927 -0.654 . . . . 10.0 112.958 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -101.4 148.62 24.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.782 0.291 . . . . 10.0 110.285 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 70' ' ' ARG . 9.6 ptm180 -89.3 131.43 35.4 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.99 0.424 . . . . 10.0 110.376 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 45.7 mm -69.89 120.91 18.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.217 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -85.19 169.19 14.08 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.326 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.409 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 38.7 m-20 -72.62 -30.75 64.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.905 0.383 . . . . 10.0 111.237 -179.353 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 18.1 p-10 -91.23 9.38 31.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.877 0.37 . . . . 10.0 111.146 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.407 ' HB2' ' O ' ' A' ' 72' ' ' ALA . 1.4 m170 -74.94 148.97 39.56 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.107 0.48 . . . . 10.0 110.765 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.606 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -133.59 145.42 56.22 Favored Pre-proline 0 C--N 1.32 -0.689 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.082 179.33 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . 0.493 ' HB2' ' SD ' ' A' ' 40' ' ' MET . 31.6 Cg_exo -59.04 -13.27 18.3 Favored 'Trans proline' 0 N--CA 1.477 0.522 0 C-N-CA 122.834 2.356 . . . . 10.0 112.991 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -73.7 -27.57 61.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.558 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.606 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.0 pt-20 -98.65 172.45 7.47 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.694 -0.484 . . . . 10.0 109.694 179.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 31.5 mt 72.26 -55.9 0.66 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.685 0.616 . . . . 10.0 110.989 -179.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 121.27 66.42 0.25 Allowed Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 121.076 -0.583 . . . . 10.0 112.377 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 60.6 mtt -96.78 137.4 35.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.555 0.217 . . . . 10.0 110.497 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.475 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 2.4 mm-40 -138.04 -173.04 3.4 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.042 0.449 . . . . 10.0 111.307 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.427 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 24.6 tp10 -73.67 140.58 46.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.001 -0.545 . . . . 10.0 109.909 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 68.25 23.59 7.75 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.604 0.565 . . . . 10.0 110.682 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.5 t0 -72.18 152.53 42.2 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.071 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 41.3 t -107.19 122.66 61.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.439 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.9 tt -126.27 134.34 66.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -103.34 145.92 29.24 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.771 0.32 . . . . 10.0 111.312 -178.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -126.99 125.31 66.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.115 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -130.19 157.31 42.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.608 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -82.97 131.74 35.17 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.101 -0.333 . . . . 10.0 110.101 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.474 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.2 mm-40 -78.92 154.54 29.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.66 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -70.51 -14.83 62.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.96 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.5 p -74.43 -25.42 59.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.759 179.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.84 -9.59 44.02 Favored Glycine 0 C--N 1.332 0.328 0 CA-C-N 115.919 -0.582 . . . . 10.0 112.107 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.799 -1.001 . . . . 10.0 110.928 -179.339 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 7.0 t30 . . . . . 0 N--CA 1.483 1.203 0 CA-C-O 121.07 0.462 . . . . 10.0 110.62 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 57.2 t-20 -118.08 124.71 48.74 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 109.052 -0.722 . . . . 10.0 109.052 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -122.98 128.26 49.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.225 0.536 . . . . 10.0 111.554 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . 0.436 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 18.5 t0 -122.19 130.2 24.8 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 108.376 -0.972 . . . . 10.0 108.376 178.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 59.9 Cg_endo -109.13 127.56 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.115 0 C-N-CA 121.275 1.317 . . . . 10.0 113.904 -179.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 2.0 mt -119.96 136.89 55.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 113.815 -1.539 . . . . 10.0 109.192 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 3.1 t -113.95 135.79 52.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-O 121.659 0.742 . . . . 10.0 109.861 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 3.6 tp . . . . . 0 C--N 1.314 -0.936 0 CA-C-N 114.248 -1.342 . . . . 10.0 111.326 -176.874 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 . . . . . 0 N--CA 1.483 1.219 0 CA-C-O 120.468 0.175 . . . . 10.0 110.588 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 38.1 mm -114.1 116.0 51.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.436 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.2 ttpm? -99.95 106.53 18.34 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.986 0.422 . . . . 10.0 110.451 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 31.2 mt -90.99 150.92 21.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.648 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.5 mtpt -107.16 109.68 21.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.283 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.451 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.4 t -92.6 126.59 45.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 179.223 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 27.3 mm -94.8 112.22 26.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.978 0.418 . . . . 10.0 110.992 -179.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.25 160.66 35.03 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.776 -0.647 . . . . 10.0 112.028 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.9 tp60 -63.08 -32.82 74.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.044 0.387 . . . . 10.0 112.044 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -88.9 25.66 1.74 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.777 0.322 . . . . 10.0 111.52 -179.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.6 m 65.66 42.58 3.56 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.251 0.548 . . . . 10.0 111.13 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.6 p -101.82 135.11 43.92 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.276 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -108.49 96.39 6.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.272 0.558 . . . . 10.0 109.495 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.451 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 7.2 mm -79.99 129.67 37.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.682 -0.69 . . . . 10.0 111.261 -178.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -101.32 86.23 2.95 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.624 -0.717 . . . . 10.0 109.654 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.27 117.77 30.47 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.506 -0.478 . . . . 10.0 110.167 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -93.22 104.11 16.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.401 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.4 m -103.54 170.49 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.341 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -123.12 135.72 54.49 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.272 -0.27 . . . . 10.0 110.272 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.55 ' O ' ' HB ' ' A' ' 41' ' ' THR . 62.3 tpp -74.13 76.24 1.76 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.437 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.55 ' HB ' ' O ' ' A' ' 40' ' ' MET . 12.0 t 170.39 -24.86 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.334 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.79 151.95 24.0 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.188 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -74.03 144.27 45.17 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.762 -0.653 . . . . 10.0 110.099 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 58.7 mt -75.0 -4.19 36.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.003 0.43 . . . . 10.0 110.616 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.3 tptt -58.17 -50.86 72.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.627 -0.715 . . . . 10.0 109.549 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.425 ' HG3' HD11 ' B' ' 364' ' ' ILE . 4.0 tppp? -63.21 -39.14 93.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.765 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -62.29 -43.37 98.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.072 -0.513 . . . . 10.0 111.582 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -62.62 -45.39 93.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.29 -0.414 . . . . 10.0 112.082 -179.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -73.52 -35.78 65.63 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.0 -0.28 . . . . 10.0 111.715 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.0 m -64.72 -30.81 71.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.952 0.406 . . . . 10.0 110.807 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -69.14 -36.23 77.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.102 0.477 . . . . 10.0 109.796 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.568 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.3 m -63.5 -37.1 86.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.179 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -63.55 -34.61 78.17 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.399 179.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -69.85 -37.93 76.31 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.573 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -79.88 -18.29 51.04 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.796 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.34 24.62 62.97 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.933 -0.651 . . . . 10.0 112.018 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.417 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 18.3 m -124.93 155.92 69.75 Favored Pre-proline 0 C--N 1.325 -0.46 0 N-CA-C 110.618 -0.142 . . . . 10.0 110.618 -179.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -65.18 154.62 72.62 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.553 2.169 . . . . 10.0 111.993 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.568 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 17.2 ttt -67.5 157.91 33.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.853 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 33.5 t30 79.21 4.16 2.29 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.767 0.827 . . . . 10.0 111.656 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -93.29 -20.61 20.24 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.126 0.489 . . . . 10.0 109.994 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 43.2 mt -116.81 137.81 51.94 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.771 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.49 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 20.1 ptt-85 -107.44 132.04 53.62 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.258 179.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -95.72 115.56 27.6 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.5 mt -105.52 112.5 25.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.065 0.459 . . . . 10.0 110.717 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -117.86 110.63 18.0 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.343 179.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 61.51 28.62 17.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.464 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.18 -21.43 46.05 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.9 -0.667 . . . . 10.0 113.815 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -99.06 150.96 21.47 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 117.269 0.535 . . . . 10.0 111.192 -178.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.2 ptm85 -87.09 134.68 33.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.157 0.503 . . . . 10.0 110.565 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.9 mm -75.25 125.48 34.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.998 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -85.32 168.79 14.36 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.301 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.81 -25.72 59.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.92 0.39 . . . . 10.0 110.872 -179.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -98.08 20.59 12.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.761 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.5 m170 -88.77 156.97 18.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.729 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.484 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 5.0 p -134.78 154.74 79.58 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.83 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -64.85 -15.01 48.21 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.382 2.055 . . . . 10.0 112.119 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -70.1 -40.37 74.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.817 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.4 pt-20 -85.54 167.9 14.99 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.818 -0.438 . . . . 10.0 109.818 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.1 mt 73.06 -53.04 0.71 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.108 0.563 . . . . 10.0 110.754 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.79 81.41 0.86 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.931 -0.652 . . . . 10.0 112.464 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.2 mtt -109.11 132.0 54.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.685 0.279 . . . . 10.0 110.286 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -128.66 -177.11 4.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.555 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.436 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 21.5 tp10 -74.89 137.03 41.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.446 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 68.89 28.19 5.38 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.675 0.609 . . . . 10.0 111.203 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.82 153.94 30.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.005 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 67.2 t -105.53 132.7 51.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.975 0.416 . . . . 10.0 111.744 -178.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.1 tt -136.95 143.36 35.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.088 -0.708 . . . . 10.0 109.088 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -110.69 149.82 29.92 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.951 0.405 . . . . 10.0 111.472 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.6 p -136.91 132.17 47.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.841 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -139.02 165.32 27.45 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.447 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -80.19 135.97 36.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.232 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.49 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.1 mm-40 -78.49 171.07 15.64 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.861 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -89.17 -5.59 57.61 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.108 0.48 . . . . 10.0 109.855 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.0 p -78.07 -67.76 0.7 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.68 -0.691 . . . . 10.0 111.123 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 130.13 -28.79 3.81 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.001 -0.619 . . . . 10.0 111.93 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.69 -1.061 . . . . 10.0 111.538 179.658 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 42.0 t30 . . . . . 0 N--CA 1.483 1.205 0 CA-C-O 120.962 0.41 . . . . 10.0 110.392 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -122.32 121.38 36.6 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.382 -0.97 . . . . 10.0 108.382 177.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -126.25 128.71 47.62 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.9 0.704 . . . . 10.0 112.9 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . 0.41 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 28.6 t70 -124.18 129.71 24.63 Favored Pre-proline 0 C--N 1.313 -0.989 0 N-CA-C 106.73 -1.581 . . . . 10.0 106.73 175.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 43.6 Cg_endo -109.84 127.92 0.04 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 121.843 1.696 . . . . 10.0 113.959 -178.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.9 mt -118.95 135.93 57.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 114.739 -1.119 . . . . 10.0 110.112 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 1.4 t -113.29 135.4 52.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.129 -0.487 . . . . 10.0 109.94 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . 0.425 HD11 ' HG3' ' A' ' 46' ' ' LYS . 6.1 tp . . . . . 0 C--N 1.316 -0.871 0 CA-C-N 114.964 -1.016 . . . . 10.0 110.929 -177.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 110.161 -0.311 . . . . 10.0 110.161 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.5 mm -113.86 125.83 71.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.368 -0.378 . . . . 10.0 109.983 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -96.46 105.16 17.2 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.083 0.468 . . . . 10.0 111.213 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 91.3 mt -90.6 140.85 29.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.905 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.2 mtpt -106.53 116.47 31.98 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.933 0.397 . . . . 10.0 111.135 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.509 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.8 t -101.98 123.84 55.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 37.7 mm -97.78 108.52 21.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.063 0.459 . . . . 10.0 110.832 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.29 170.9 54.31 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.678 -0.692 . . . . 10.0 112.014 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -70.63 -19.17 62.84 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.974 0.416 . . . . 10.0 110.898 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -96.38 21.66 8.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.454 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.3 m 61.97 37.47 14.98 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.476 -0.784 . . . . 10.0 111.136 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 p -90.18 138.93 31.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.126 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 2.0 mt-10 -104.7 94.05 5.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.095 0.474 . . . . 10.0 110.051 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.509 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 19.6 mm -80.84 121.64 34.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.027 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -103.01 88.05 3.07 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.518 -0.549 . . . . 10.0 109.518 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -91.01 114.58 27.14 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.405 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.6 ttmt -86.99 97.99 11.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.046 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.487 HG12 HD11 ' A' ' 47' ' ' LEU . 4.0 m -100.72 172.95 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.621 -179.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 tttt -124.55 135.6 53.29 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.82 -0.437 . . . . 10.0 109.82 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 56.8 tpp -74.61 78.64 1.99 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.891 0.377 . . . . 10.0 111.313 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 7.0 t 174.67 -32.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.336 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.22 148.43 33.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.888 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -72.16 148.96 45.13 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.407 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 80.1 mt -71.22 -6.51 40.19 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.997 0.427 . . . . 10.0 110.463 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.473 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 42.7 tptt -57.38 -52.86 63.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.752 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -60.79 -33.82 73.56 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.221 -0.9 . . . . 10.0 111.072 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.487 HD11 HG12 ' A' ' 38' ' ' VAL . 4.0 mm? -69.63 -44.98 69.54 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.223 -179.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 57.1 mtpt -61.13 -47.01 88.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.982 -178.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 6.5 pt-20 -68.06 -43.07 79.48 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.932 -0.307 . . . . 10.0 111.603 -179.074 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.1 m -62.7 -34.28 76.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.702 0.287 . . . . 10.0 111.199 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -66.6 -38.85 87.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.697 0.284 . . . . 10.0 110.291 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.578 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.5 m -63.47 -41.28 98.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 10.0 109.828 179.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -64.25 -36.61 84.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.328 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -63.02 -32.08 73.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.847 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -89.63 -31.13 17.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.718 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 106.96 -19.92 34.46 Favored Glycine 0 C--O 1.23 -0.135 0 C-N-CA 121.111 -0.566 . . . . 10.0 112.251 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.414 HG22 ' H ' ' A' ' 57' ' ' VAL . 5.0 m -77.29 155.5 81.93 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 110.543 -0.169 . . . . 10.0 110.543 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -62.11 168.03 9.83 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.479 2.12 . . . . 10.0 111.875 179.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.578 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 24.9 ttt -70.46 148.16 48.63 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.785 0.326 . . . . 10.0 111.45 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t30 73.52 6.78 5.09 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.124 -0.944 . . . . 10.0 112.501 178.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.3 p -76.73 -24.85 53.03 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.852 -0.795 . . . . 10.0 108.852 178.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 56.1 mt -115.15 132.24 56.67 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 114.863 -1.062 . . . . 10.0 109.757 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.54 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 13.2 ptt-85 -100.86 129.98 46.8 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.202 -0.453 . . . . 10.0 110.417 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.472 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 64.9 m-85 -91.42 119.1 31.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.018 179.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.8 mt -108.98 121.24 44.7 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.539 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -129.96 111.07 12.18 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.652 -0.703 . . . . 10.0 109.627 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 66.57 23.5 10.36 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.214 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.94 -8.23 70.32 Favored Glycine 0 N--CA 1.453 -0.195 0 C-N-CA 121.014 -0.612 . . . . 10.0 113.1 179.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -109.33 144.14 37.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.587 0.232 . . . . 10.0 110.668 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.472 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 11.9 ptm180 -84.01 133.83 34.66 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.173 0.511 . . . . 10.0 110.438 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.1 mm -71.68 125.02 29.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.878 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.02 167.22 19.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.09 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.39 -25.25 59.37 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.162 0.506 . . . . 10.0 110.719 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -96.13 13.74 26.24 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.791 -0.64 . . . . 10.0 111.073 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.9 m170 -85.35 152.52 23.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.149 0.5 . . . . 10.0 111.223 -179.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.515 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 35.4 p -124.43 155.58 68.58 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.95 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -70.94 -10.78 28.27 Favored 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.166 1.911 . . . . 10.0 112.19 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -77.76 -30.1 51.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.386 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.2 pt-20 -92.81 174.69 7.12 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.583 -0.525 . . . . 10.0 109.583 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 4.8 mt 72.89 -56.59 0.66 Allowed 'General case' 0 N--CA 1.469 0.503 0 O-C-N 123.548 0.53 . . . . 10.0 111.017 -179.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 126.16 66.12 0.17 Allowed Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 121.206 -0.521 . . . . 10.0 111.917 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 55.7 mtt -101.85 134.21 45.39 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.738 0.304 . . . . 10.0 110.367 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 0.3 OUTLIER -138.65 178.61 7.02 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.766 -179.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.429 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 13.4 tp10 -67.02 143.71 56.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.265 -0.425 . . . . 10.0 109.944 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 22.4 mm-40 70.4 22.24 5.36 Favored 'General case' 0 C--O 1.232 0.169 0 O-C-N 123.716 0.635 . . . . 10.0 111.732 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.3 OUTLIER -78.89 153.23 30.68 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.352 179.433 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 89.6 t -115.77 128.45 73.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.441 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.9 tt -124.49 144.61 33.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.434 -0.58 . . . . 10.0 109.434 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -105.38 144.84 31.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.849 0.357 . . . . 10.0 110.893 -178.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 9.8 p -135.81 129.86 48.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.987 0.422 . . . . 10.0 110.226 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -135.54 167.69 20.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.508 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -83.18 134.1 34.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.714 0.293 . . . . 10.0 111.145 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.54 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 3.0 mm-40 -74.14 152.42 39.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.396 179.491 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -70.3 -17.16 63.08 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.774 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.2 p -77.08 -25.12 51.97 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.191 0.519 . . . . 10.0 110.639 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.25 -3.81 86.59 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.933 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.822 -0.988 . . . . 10.0 111.295 -179.732 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 65.9 t30 . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 121.014 0.435 . . . . 10.0 110.595 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 54.1 t30 -121.77 122.24 39.05 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.532 -0.914 . . . . 10.0 108.532 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . 0.481 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 23.2 ptt180 -126.0 128.7 47.87 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 119.791 -0.764 . . . . 10.0 112.035 179.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . 0.406 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 28.2 t70 -120.8 130.87 24.65 Favored Pre-proline 0 C--N 1.316 -0.864 0 N-CA-C 106.8 -1.556 . . . . 10.0 106.8 177.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 58.4 Cg_endo -108.07 128.61 0.05 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.524 0 C-N-CA 121.481 1.454 . . . . 10.0 113.179 -178.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.2 mt -119.27 136.99 54.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 114.128 -1.396 . . . . 10.0 109.734 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 48.7 t -113.25 135.21 53.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.269 0.557 . . . . 10.0 109.59 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 7.1 tp . . . . . 0 C--N 1.317 -0.82 0 CA-C-N 114.854 -1.067 . . . . 10.0 110.594 -177.132 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.5 mm -113.02 124.43 69.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 110.002 -0.37 . . . . 10.0 110.002 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.403 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 2.8 ttpm? -102.38 112.98 25.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.032 0.444 . . . . 10.0 110.385 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.1 mt -98.07 135.49 39.68 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.307 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -95.34 113.45 25.12 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.671 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.537 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.5 t -96.41 128.42 47.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.745 -0.662 . . . . 10.0 109.584 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.3 mm -101.54 109.49 25.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 120.838 0.352 . . . . 10.0 110.747 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -76.74 174.09 54.27 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 121.027 -0.606 . . . . 10.0 112.626 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 13.8 tp60 -69.92 -29.91 67.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.81 0.338 . . . . 10.0 111.662 -179.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -104.96 40.6 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.062 0.458 . . . . 10.0 111.17 -179.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.7 m 57.9 36.0 25.87 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.692 -0.686 . . . . 10.0 111.328 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.65 94.42 9.85 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.691 -0.686 . . . . 10.0 109.929 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.644 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 20.6 mt-10 -78.64 104.9 9.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.086 0.47 . . . . 10.0 109.784 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.1 mm -95.57 136.79 25.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.28 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 45.9 m-70 -110.97 95.33 5.48 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.512 -0.551 . . . . 10.0 109.512 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.04 121.28 34.22 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.356 -0.383 . . . . 10.0 110.499 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -89.17 107.4 19.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.809 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.407 HG12 HD11 ' A' ' 47' ' ' LEU . 4.4 m -110.27 171.05 3.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.969 0.414 . . . . 10.0 110.94 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 75.4 tttt -122.33 140.56 52.52 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.538 ' O ' ' HB ' ' A' ' 41' ' ' THR . 51.6 tpp -74.94 74.9 2.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.745 0.307 . . . . 10.0 111.449 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.538 ' HB ' ' O ' ' A' ' 40' ' ' MET . 14.5 t 169.82 -24.91 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.559 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -75.99 149.6 37.58 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.887 0.375 . . . . 10.0 110.934 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 25.4 m170 -78.36 138.31 38.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.003 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.1 mt -65.69 -16.17 63.5 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.528 -0.305 . . . . 10.0 111.46 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.44 ' HD2' ' HB3' ' A' ' 73' ' ' ASP . 34.7 tttp -60.31 -42.9 96.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.012 0.434 . . . . 10.0 109.91 178.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -65.58 -30.72 71.49 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.034 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.407 HD11 HG12 ' A' ' 38' ' ' VAL . 4.4 mm? -74.56 -49.13 23.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.626 -0.715 . . . . 10.0 111.094 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -56.61 -46.8 80.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.567 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -65.21 -40.37 94.05 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.282 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 65.9 m -67.41 -34.66 77.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.311 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -63.37 -40.84 98.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.995 0.426 . . . . 10.0 109.869 179.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 39.0 m -62.73 -42.21 99.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.767 179.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -64.76 -30.41 71.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.646 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -72.52 -45.15 60.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.033 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -76.56 -14.12 60.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.409 -0.36 . . . . 10.0 111.01 -179.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.71 37.17 17.41 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.864 -0.684 . . . . 10.0 112.178 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.6 m -130.42 155.4 81.08 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-O 120.511 0.196 . . . . 10.0 110.547 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -66.22 163.95 29.82 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 122.176 1.917 . . . . 10.0 111.92 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 12.1 tpt -70.62 150.68 45.78 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 110.065 -0.346 . . . . 10.0 110.065 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.0 t30 73.75 5.99 4.9 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.105 0.562 . . . . 10.0 112.166 179.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 80.4 p -84.0 -23.29 31.05 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.145 0.497 . . . . 10.0 110.351 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 43.7 mt -121.21 147.21 45.92 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.428 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.441 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 18.0 ptt-85 -116.9 134.24 55.01 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.243 -0.435 . . . . 10.0 109.963 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.415 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 86.0 m-85 -95.9 128.29 42.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.091 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 90.7 mt -112.23 125.89 54.64 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.229 0.538 . . . . 10.0 111.369 -179.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -137.59 118.51 14.25 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.537 -0.912 . . . . 10.0 108.537 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 66.23 19.6 11.07 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.218 0.532 . . . . 10.0 110.494 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.16 -4.84 84.61 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.221 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -105.39 145.46 30.77 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.189 -0.3 . . . . 10.0 110.189 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.415 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 12.1 ptm180 -85.0 125.76 32.98 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.089 0.471 . . . . 10.0 110.214 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 43.6 mm -63.98 123.58 17.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.313 -0.858 . . . . 10.0 111.52 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.07 166.22 15.19 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.203 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.44 ' HB3' ' HD2' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -73.89 -19.15 60.79 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.995 0.426 . . . . 10.0 111.378 -179.389 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -97.06 17.22 17.53 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.117 -0.492 . . . . 10.0 111.045 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -99.94 153.03 19.5 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.051 0.453 . . . . 10.0 111.129 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.424 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 57.5 p -131.63 162.82 53.9 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 108.961 -0.755 . . . . 10.0 108.961 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -69.99 -5.91 17.47 Favored 'Trans proline' 0 CA--C 1.53 0.317 0 C-N-CA 122.33 2.02 . . . . 10.0 112.16 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.64 -30.38 61.61 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.683 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.49 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 1.4 pt-20 -101.38 171.56 7.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.162 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 7.5 mt 73.26 -49.0 0.69 Allowed 'General case' 0 N--CA 1.469 0.498 0 O-C-N 123.699 0.624 . . . . 10.0 111.285 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 113.53 76.27 0.73 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.83 -0.7 . . . . 10.0 112.443 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 58.1 mtt -105.76 122.46 46.12 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.837 0.351 . . . . 10.0 110.265 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.533 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 5.4 mm-40 -120.97 -178.75 3.82 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.949 -179.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.403 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 15.9 tp10 -70.74 144.03 51.06 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 179.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 67.04 23.54 9.7 Favored 'General case' 0 N--CA 1.462 0.171 0 O-C-N 123.523 0.514 . . . . 10.0 110.904 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.533 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.8 OUTLIER -75.6 148.51 38.75 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.862 -0.421 . . . . 10.0 109.862 179.788 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 94.8 t -107.13 119.57 56.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.038 0.447 . . . . 10.0 111.446 -178.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.537 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 15.6 tt -118.49 136.36 55.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -103.07 150.65 23.39 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.84 0.352 . . . . 10.0 110.975 -178.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.6 p -136.43 131.43 48.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.012 179.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -135.02 159.87 40.14 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.411 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -73.49 136.92 44.2 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.505 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.441 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 1.3 mm-40 -73.5 159.62 32.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.697 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -72.98 -24.79 60.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.191 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.8 p -78.28 -34.27 49.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.214 0.53 . . . . 10.0 110.899 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.31 12.92 77.84 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.925 -0.87 . . . . 10.0 110.925 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.947 0 CA-C-O 118.876 -0.958 . . . . 10.0 111.283 -179.642 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 . . . . . 0 N--CA 1.48 1.025 0 CA-C-O 121.347 0.594 . . . . 10.0 110.168 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . 0.644 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 2.5 m-20 -120.17 125.88 49.3 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 108.454 -0.943 . . . . 10.0 108.454 179.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 22.3 ptt180 -125.84 122.05 35.02 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 119.378 -0.929 . . . . 10.0 113.019 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -128.46 127.27 23.64 Favored Pre-proline 0 C--N 1.316 -0.888 0 N-CA-C 107.536 -1.283 . . . . 10.0 107.536 174.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -110.78 126.34 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.154 0 C-N-CA 121.66 1.573 . . . . 10.0 113.086 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.7 mt -120.27 135.56 60.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.027 -0.988 . . . . 10.0 109.707 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 21.6 t -113.19 135.74 51.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.47 0.652 . . . . 10.0 109.721 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . 0.426 HD12 ' HA ' ' B' ' 364' ' ' ILE . 7.8 tp . . . . . 0 C--N 1.324 -0.522 0 CA-C-N 114.836 -1.075 . . . . 10.0 112.107 -176.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 . . . . . 0 N--CA 1.478 0.95 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.418 ' O ' HG22 ' A' ' 38' ' ' VAL . 39.1 mm -118.55 113.4 41.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.762 -0.459 . . . . 10.0 109.762 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.418 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 2.6 ttpm? -96.7 111.61 23.7 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.236 -0.438 . . . . 10.0 109.9 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 30.1 mt -94.03 150.87 19.95 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.4 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 38.0 mtpt -110.31 107.53 17.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.284 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.488 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 3.2 t -89.08 126.21 42.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.598 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.9 mm -93.54 115.87 33.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 120.984 0.421 . . . . 10.0 111.188 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.59 147.1 19.75 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 111.256 -0.738 . . . . 10.0 111.256 178.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -64.47 -21.14 66.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.778 0.323 . . . . 10.0 111.811 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -95.45 28.21 3.03 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 120.857 0.36 . . . . 10.0 111.021 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.1 m 61.0 66.42 0.9 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.588 0.708 . . . . 10.0 110.919 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.2 p -136.59 144.85 44.34 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.096 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -118.57 103.86 10.12 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.488 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 5.5 mm -88.77 119.74 36.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.197 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -96.93 96.53 8.58 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -97.3 112.86 24.49 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.398 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -86.73 103.13 14.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.977 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.418 HG22 ' O ' ' A' ' 22' ' ' ILE . 2.9 m -108.31 173.13 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.816 0.341 . . . . 10.0 110.675 -179.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.433 ' HD2' ' CG2' ' A' ' 41' ' ' THR . 23.4 ttmt -121.9 137.79 54.65 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.298 -0.63 . . . . 10.0 109.298 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.45 ' O ' ' HB ' ' A' ' 41' ' ' THR . 61.9 tpp -73.94 78.9 1.65 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.957 0.408 . . . . 10.0 110.598 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.45 ' HB ' ' O ' ' A' ' 40' ' ' MET . 15.3 t 174.09 -26.33 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.444 -0.798 . . . . 10.0 110.081 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.31 151.88 26.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.417 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.415 ' ND1' ' HB3' ' A' ' 45' ' ' LYS . 6.3 p80 -76.87 145.55 38.26 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.097 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.5 mt -71.83 -8.97 57.47 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.588 -0.278 . . . . 10.0 111.285 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.415 ' HB3' ' ND1' ' A' ' 43' ' ' HIS . 47.3 tptt -59.47 -48.2 82.57 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.061 0.458 . . . . 10.0 110.007 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.574 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.4 tppp? -62.85 -33.94 76.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.309 -0.859 . . . . 10.0 110.715 179.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.414 HD11 HG12 ' A' ' 38' ' ' VAL . 3.1 mm? -71.98 -44.24 63.83 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.286 -179.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -61.63 -42.6 99.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.297 -0.41 . . . . 10.0 111.399 -179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -72.34 -39.83 67.84 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 121.001 -0.28 . . . . 10.0 111.289 -179.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.437 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 66.4 m -63.45 -35.77 81.53 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.75 0.31 . . . . 10.0 111.411 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -64.32 -41.46 96.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.799 0.333 . . . . 10.0 110.177 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 57.2 m -62.3 -38.23 88.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.348 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.437 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.4 mt-30 -65.9 -42.9 89.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.79 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -61.75 -35.67 78.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.417 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -83.22 -16.82 45.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.849 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.31 35.58 42.25 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.094 -0.574 . . . . 10.0 112.535 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.3 m -131.37 155.55 81.34 Favored Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 110.24 -0.282 . . . . 10.0 110.24 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.34 159.57 39.18 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.358 2.039 . . . . 10.0 111.769 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 16.0 ttt -71.01 155.95 40.21 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 121.225 -0.19 . . . . 10.0 110.702 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 32.8 t30 76.65 -7.38 1.85 Allowed 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.542 0.737 . . . . 10.0 111.981 179.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.5 p -75.79 -19.45 58.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.226 0.536 . . . . 10.0 110.276 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.3 mt -116.97 135.27 53.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.253 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.433 ' HD3' ' OE2' ' A' ' 93' ' ' GLU . 7.1 ptt180 -111.34 119.96 40.61 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.145 0.498 . . . . 10.0 110.432 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -88.22 124.92 34.33 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.889 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 34.2 mt -114.5 124.86 52.97 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.044 0.449 . . . . 10.0 110.974 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -135.17 119.88 18.3 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.281 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 64.78 20.57 12.17 Favored 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.433 0.458 . . . . 10.0 111.136 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.71 2.45 81.75 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.912 -0.661 . . . . 10.0 112.302 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -114.76 145.06 42.52 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.749 -0.463 . . . . 10.0 109.749 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -80.98 142.19 33.69 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.975 0.417 . . . . 10.0 109.901 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.2 mm -79.28 121.17 31.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.427 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.7 169.47 18.18 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.505 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -81.71 -18.27 44.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.808 0.337 . . . . 10.0 111.085 -179.06 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -101.86 0.96 36.44 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.781 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 18.4 m170 -71.53 159.13 35.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.936 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.6 p -134.57 160.71 67.42 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.826 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -67.12 -14.66 44.15 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.454 2.103 . . . . 10.0 112.249 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -69.28 -46.41 67.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.527 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -82.79 172.91 12.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.147 -0.478 . . . . 10.0 109.839 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.0 mt 73.45 -46.56 0.64 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.164 0.586 . . . . 10.0 111.047 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 110.9 63.48 0.5 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 121.185 -0.531 . . . . 10.0 112.68 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 43.5 mtt -101.68 128.45 47.99 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.844 0.354 . . . . 10.0 110.711 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 2.8 mm-40 -132.56 -174.39 3.44 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.63 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.418 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 42.5 tp10 -66.28 138.33 57.57 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.183 -179.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 66.27 26.3 10.39 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 123.727 0.642 . . . . 10.0 111.9 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.4 OUTLIER -76.3 141.52 41.59 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.851 -0.426 . . . . 10.0 109.851 179.04 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 59.6 t -96.36 120.26 45.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.504 -178.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 15.3 tt -128.8 138.16 55.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.646 -0.707 . . . . 10.0 109.193 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -112.74 149.7 32.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.97 0.414 . . . . 10.0 111.462 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.4 p -130.96 133.86 62.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.184 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -124.84 168.77 12.79 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.985 -0.552 . . . . 10.0 109.577 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -83.08 138.76 33.57 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.362 -0.607 . . . . 10.0 109.362 178.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.433 ' OE2' ' HD3' ' A' ' 63' ' ' ARG . 2.8 mm-40 -74.67 170.41 15.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.197 0.522 . . . . 10.0 111.139 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -82.87 -28.87 29.75 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.483 -0.78 . . . . 10.0 109.687 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -74.35 -55.15 6.33 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.603 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 104.4 11.87 30.26 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.608 -0.806 . . . . 10.0 112.835 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.794 0 CA-C-O 118.891 -0.949 . . . . 10.0 111.913 179.548 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 121.22 0.534 . . . . 10.0 110.869 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 63.0 t-20 -121.16 124.09 43.88 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.458 -0.571 . . . . 10.0 109.458 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 33.2 ptt180 -123.3 126.08 46.24 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.286 0.565 . . . . 10.0 112.507 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -125.33 128.68 24.68 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 108.263 -1.014 . . . . 10.0 108.263 176.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -111.02 128.0 0.03 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 121.851 1.7 . . . . 10.0 113.52 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 6.1 mt -120.51 137.26 54.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 114.807 -1.088 . . . . 10.0 109.965 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 37.7 t -112.54 134.57 54.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.309 -0.626 . . . . 10.0 109.309 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . 0.574 HD11 ' HG3' ' A' ' 46' ' ' LYS . 7.6 tp . . . . . 0 C--N 1.318 -0.777 0 CA-C-N 114.809 -1.087 . . . . 10.0 111.514 -176.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 N--CA 1.475 0.822 0 CA-C-O 120.782 0.325 . . . . 10.0 110.436 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 18.1 mm -106.3 123.18 60.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.499 -0.556 . . . . 10.0 109.499 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.478 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 4.5 ttpm? -96.47 108.12 20.63 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.183 0.516 . . . . 10.0 110.691 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.8 mt -93.36 137.37 32.73 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.844 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -99.87 106.97 18.86 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.116 0.484 . . . . 10.0 110.819 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.0 t -89.41 130.15 39.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.293 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 41.7 mm -91.01 111.59 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.905 0.383 . . . . 10.0 110.779 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -77.37 157.86 46.8 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.689 -0.687 . . . . 10.0 112.235 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 12.6 tp60 -58.52 -32.24 68.65 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -97.07 29.16 3.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.775 0.321 . . . . 10.0 111.387 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 m 64.52 35.4 9.38 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.351 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.23 136.98 32.72 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.725 -0.67 . . . . 10.0 110.101 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -100.16 101.04 11.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.891 0.376 . . . . 10.0 110.344 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -88.61 120.61 37.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.268 -0.423 . . . . 10.0 109.94 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -100.18 98.62 9.3 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -99.98 118.63 36.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.143 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.4 ttmt -91.9 103.49 16.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.241 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 5.0 m -100.2 171.36 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.24 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -121.53 141.73 50.77 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.225 -0.443 . . . . 10.0 109.976 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.411 ' O ' ' HB ' ' A' ' 41' ' ' THR . 57.8 tpp -81.08 73.05 8.13 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.016 0.436 . . . . 10.0 111.032 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.411 ' HB ' ' O ' ' A' ' 40' ' ' MET . 8.9 t 175.95 -26.16 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.192 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.57 147.36 25.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.254 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 29.8 m80 -75.52 148.8 38.67 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.242 -0.281 . . . . 10.0 110.242 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.514 ' HA ' HD23 ' A' ' 47' ' ' LEU . 35.7 mt -67.66 -10.53 53.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.813 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.552 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 51.2 tptt -57.77 -43.85 85.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.766 -0.652 . . . . 10.0 109.738 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -67.4 -32.21 72.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.395 -0.821 . . . . 10.0 110.956 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.514 HD23 ' HA ' ' A' ' 44' ' ' LEU . 2.7 mm? -74.05 -42.92 59.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.542 -178.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -59.76 -48.37 81.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.939 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 20.0 pt-20 -67.7 -37.81 82.77 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.864 0.32 . . . . 10.0 111.864 -178.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.6 m -68.34 -32.6 72.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.695 0.283 . . . . 10.0 111.463 -179.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 50.1 t80 -66.87 -39.05 87.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.893 0.377 . . . . 10.0 110.224 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.528 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 81.2 m -62.17 -36.72 82.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.41 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -65.14 -35.96 82.76 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.121 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -64.8 -36.16 83.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.69 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -92.24 -6.92 49.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.394 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 69.58 36.81 77.08 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.917 -0.658 . . . . 10.0 112.43 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.512 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 17.6 m -126.0 155.21 73.59 Favored Pre-proline 0 C--N 1.323 -0.583 0 N-CA-C 110.133 -0.321 . . . . 10.0 110.133 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -68.85 157.85 60.2 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.126 1.884 . . . . 10.0 111.588 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.528 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 9.4 ttt -69.72 154.74 41.56 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.036 -0.265 . . . . 10.0 110.344 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.3 t30 77.35 -3.59 2.43 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 123.939 0.775 . . . . 10.0 111.575 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 87.5 p -83.84 -19.0 35.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.204 0.526 . . . . 10.0 109.71 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 82.6 mt -117.02 126.13 52.41 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.268 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.465 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.8 ptt-85 -100.0 121.86 42.02 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.095 0.474 . . . . 10.0 109.858 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -89.99 111.9 23.13 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.8 mt -99.61 113.3 25.64 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.227 -178.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -113.82 101.61 9.45 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.375 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 60.57 38.37 18.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.026 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.07 -34.0 4.79 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.852 -0.613 . . . . 10.0 113.045 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -83.7 135.04 34.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.716 0.294 . . . . 10.0 110.819 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -83.46 131.81 35.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.979 0.419 . . . . 10.0 110.416 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 48.3 mm -68.27 120.64 16.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.824 -0.625 . . . . 10.0 111.583 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.14 177.67 8.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.278 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.552 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 0.8 OUTLIER -83.86 -14.02 52.22 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.552 -0.294 . . . . 10.0 111.504 -179.074 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.4 p-10 -108.89 9.88 26.57 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.679 -0.237 . . . . 10.0 111.391 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.4 ' HB3' HD12 ' A' ' 44' ' ' LEU . 3.1 m170 -78.56 157.36 28.81 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.957 0.408 . . . . 10.0 111.265 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.541 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.8 OUTLIER -136.54 154.0 76.46 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.64 179.521 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -66.42 -11.0 29.71 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.741 2.294 . . . . 10.0 112.745 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -74.62 -24.34 58.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.32 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.541 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.5 pt-20 -107.18 -179.01 3.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.123 -0.49 . . . . 10.0 109.713 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.44 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 6.1 mt 71.21 -62.76 0.44 Allowed 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.762 0.664 . . . . 10.0 111.113 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 130.59 59.89 0.1 OUTLIER Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 111.654 -0.578 . . . . 10.0 111.654 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 53.6 mtt -97.38 125.93 42.31 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.75 0.31 . . . . 10.0 110.827 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.441 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.6 mm-40 -127.64 -175.39 3.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.878 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.478 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 15.3 tp10 -71.38 138.11 48.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.445 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 64.64 34.34 9.87 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 123.565 0.54 . . . . 10.0 110.723 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.0 OUTLIER -79.53 147.69 32.07 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.24 179.683 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.4 t -103.17 124.64 57.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.987 0.423 . . . . 10.0 111.585 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.4 tt -131.95 147.15 32.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.985 -0.552 . . . . 10.0 109.723 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -107.41 151.55 25.38 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.871 0.367 . . . . 10.0 111.381 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.8 p -135.83 125.83 41.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.887 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -133.18 160.59 36.79 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.73 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.78 133.79 35.14 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.398 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.465 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.9 mm-40 -76.47 150.61 36.65 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.724 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -68.14 -21.68 64.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.939 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.8 p -76.97 -15.05 59.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.949 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.29 5.32 66.42 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 121.105 -0.569 . . . . 10.0 112.296 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.876 0 CA-C-O 118.719 -1.045 . . . . 10.0 111.097 -179.426 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 54.7 t30 . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.655 0.264 . . . . 10.0 111.28 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -122.03 120.03 33.16 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.04 -1.096 . . . . 10.0 108.04 177.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -129.59 129.79 44.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.179 0.514 . . . . 10.0 112.131 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . 0.42 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 27.1 t0 -121.59 128.09 25.78 Favored Pre-proline 0 C--N 1.308 -1.218 0 N-CA-C 107.06 -1.459 . . . . 10.0 107.06 175.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 77.7 Cg_endo -108.86 128.48 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 121.89 1.726 . . . . 10.0 113.695 -178.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.3 mt -120.64 134.6 63.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 114.549 -1.205 . . . . 10.0 110.171 179.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 6.0 t -115.08 135.61 54.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 109.08 -0.711 . . . . 10.0 109.08 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . 0.44 HD12 ' HA ' ' B' ' 364' ' ' ILE . 7.2 tp . . . . . 0 C--N 1.323 -0.544 0 CA-C-N 115.503 -0.771 . . . . 10.0 112.423 -176.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 110.063 -0.347 . . . . 10.0 110.063 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.2 mm -111.49 113.23 43.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.325 -0.398 . . . . 10.0 109.962 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.516 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.9 OUTLIER -96.05 109.48 21.89 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.312 0.577 . . . . 10.0 110.282 179.629 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 67.1 mt -95.67 144.01 26.45 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.039 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.5 mtpt -104.43 109.67 21.63 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.896 0.379 . . . . 10.0 110.548 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.454 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.3 t -90.37 128.9 41.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.93 -0.577 . . . . 10.0 109.517 179.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.5 mm -87.98 109.49 19.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.369 -0.378 . . . . 10.0 111.349 -179.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.01 160.29 40.55 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.79 -0.719 . . . . 10.0 111.365 178.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -62.72 -35.84 81.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.89 0.345 . . . . 10.0 111.47 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 17.0 p-10 -88.88 27.94 1.25 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.935 0.397 . . . . 10.0 111.235 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.9 m 61.38 30.54 19.03 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.575 -0.739 . . . . 10.0 111.442 179.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.3 p -82.49 133.31 35.2 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.524 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.527 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 37.0 mt-10 -95.82 96.34 8.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.175 0.512 . . . . 10.0 110.231 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.454 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 2.1 mm -85.68 115.91 27.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.294 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.3 m170 -95.69 96.99 9.37 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.796 -0.446 . . . . 10.0 109.796 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.47 114.46 26.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.641 -179.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -91.25 105.87 18.1 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.195 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.9 m -111.41 170.5 3.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.684 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -117.21 149.31 40.62 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.877 -0.416 . . . . 10.0 109.877 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 60.4 tpp -78.27 69.64 4.51 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.557 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 173.87 -29.85 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.587 179.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.8 137.64 52.01 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.0 m80 -70.84 138.51 50.34 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.093 -0.503 . . . . 10.0 109.889 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.9 mt -66.8 -7.63 22.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.495 -0.32 . . . . 10.0 111.758 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -57.94 -49.63 76.11 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.6 ttpt -70.3 -34.24 72.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.44 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.429 ' HA ' HD13 ' A' ' 47' ' ' LEU . 2.3 mm? -65.17 -44.65 87.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.86 0.362 . . . . 10.0 110.836 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -60.26 -44.63 95.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.967 -0.56 . . . . 10.0 111.66 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.484 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 17.9 pt-20 -74.53 -34.99 63.13 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.697 -0.401 . . . . 10.0 111.221 -179.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.52 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 67.6 m -60.25 -37.36 80.17 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-O 121.072 0.463 . . . . 10.0 110.347 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -64.3 -40.83 96.72 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.562 -0.533 . . . . 10.0 109.562 178.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.414 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 56.7 m -63.93 -39.23 93.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.477 -0.783 . . . . 10.0 110.079 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.52 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 60.4 mt-30 -66.06 -36.06 82.2 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.046 179.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -67.64 -37.77 82.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.672 -0.694 . . . . 10.0 110.774 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -80.79 -29.5 36.09 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.999 0.428 . . . . 10.0 110.797 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 96.26 31.06 7.41 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.831 -0.7 . . . . 10.0 112.242 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.414 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 10.9 m -129.8 155.62 80.18 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 110.182 -0.303 . . . . 10.0 110.182 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -67.25 157.74 60.31 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.375 2.05 . . . . 10.0 111.511 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.403 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 10.6 ttt -67.0 156.4 36.1 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.892 -0.323 . . . . 10.0 111.116 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.3 t30 79.06 -8.5 1.63 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.876 0.87 . . . . 10.0 111.953 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 82.8 p -75.75 -23.7 56.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.244 0.545 . . . . 10.0 109.949 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 50.2 mt -116.0 141.33 48.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.482 -0.781 . . . . 10.0 109.981 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' A' ' 63' ' ' ARG . 12.7 ptt180 -113.13 129.19 56.59 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.988 0.423 . . . . 10.0 110.11 179.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -95.99 124.79 40.14 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.825 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.1 mt -115.29 126.16 54.15 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.159 0.505 . . . . 10.0 110.926 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -124.88 100.35 6.56 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.246 -0.888 . . . . 10.0 109.058 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 64.98 33.82 9.43 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.066 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.24 -14.42 62.38 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 115.725 -0.671 . . . . 10.0 113.24 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -97.02 136.0 38.21 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.833 -0.432 . . . . 10.0 109.833 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -83.86 140.03 32.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.096 0.474 . . . . 10.0 110.66 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 50.0 mm -77.35 118.3 23.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.728 -0.669 . . . . 10.0 111.083 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.57 160.32 21.45 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.51 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -64.84 -25.84 68.08 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.378 -0.374 . . . . 10.0 111.5 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -95.59 7.12 47.18 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.431 -0.35 . . . . 10.0 111.659 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 3.6 m170 -78.3 150.26 33.35 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.221 0.534 . . . . 10.0 111.412 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.59 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -132.34 148.66 70.59 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.578 -0.737 . . . . 10.0 110.101 179.254 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -60.38 -17.23 46.16 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.695 2.263 . . . . 10.0 112.569 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -67.01 -33.89 76.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.778 -0.647 . . . . 10.0 110.474 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.59 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.4 pt-20 -96.8 173.77 7.14 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.316 -0.402 . . . . 10.0 109.918 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.433 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 87.6 mt 72.34 -59.15 0.57 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.456 0.703 . . . . 10.0 110.512 -178.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 120.78 87.07 0.95 Allowed Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 121.211 -0.518 . . . . 10.0 111.96 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 62.4 mtt -117.61 132.73 56.46 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.611 0.243 . . . . 10.0 110.415 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -126.67 179.2 5.46 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.817 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.516 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 17.2 tp10 -69.89 137.18 51.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.071 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.468 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 5.4 mm-40 71.93 20.38 4.45 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 123.748 0.655 . . . . 10.0 111.591 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.13 147.17 38.73 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.887 -0.325 . . . . 10.0 110.278 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.9 t -99.02 133.71 40.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.88 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.7 tt -134.99 144.13 35.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 178.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -105.92 155.19 19.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.135 0.493 . . . . 10.0 111.997 -178.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.9 p -139.87 127.19 24.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.458 -0.792 . . . . 10.0 109.326 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -133.64 157.89 44.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.606 -0.27 . . . . 10.0 110.391 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -74.6 133.75 42.16 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.14 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.497 ' OE1' ' HA ' ' A' ' 93' ' ' GLU . 3.9 mm-40 -75.69 155.08 36.05 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.754 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -71.78 -24.99 61.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.46 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.2 p -66.92 -39.25 87.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.149 0.499 . . . . 10.0 110.498 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.44 0.9 75.58 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.768 -0.73 . . . . 10.0 112.195 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.825 -0.986 . . . . 10.0 111.295 -179.983 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 121.2 0.524 . . . . 10.0 110.864 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . 0.527 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 52.3 t30 -116.74 124.39 49.51 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 108.904 -0.776 . . . . 10.0 108.904 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . 0.405 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 16.5 ptt180 -124.69 128.26 48.55 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.45 0.643 . . . . 10.0 111.277 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -120.51 130.37 24.88 Favored Pre-proline 0 C--N 1.314 -0.936 0 N-CA-C 106.631 -1.618 . . . . 10.0 106.631 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -108.23 129.26 0.05 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.331 0 C-N-CA 121.728 1.618 . . . . 10.0 113.317 -178.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.8 mt -116.39 131.8 67.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.379 -1.282 . . . . 10.0 109.352 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 25.9 t -114.96 131.55 66.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.675 0.75 . . . . 10.0 109.43 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' B' ' 364' ' ' ILE . 7.0 tp . . . . . 0 C--N 1.313 -0.995 0 CA-C-N 114.126 -1.397 . . . . 10.0 110.683 -177.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 . . . . . 0 N--CA 1.478 0.933 0 N-CA-C 110.111 -0.329 . . . . 10.0 110.111 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.8 mm -96.08 113.78 31.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 109.78 -0.452 . . . . 10.0 109.78 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -98.2 115.22 27.89 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.737 0.303 . . . . 10.0 110.497 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 31.1 mt -100.92 145.51 28.55 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.526 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.437 ' HG2' ' CD2' ' A' ' 35' ' ' HIS . 42.0 mtpt -106.58 102.77 12.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.475 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.41 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.9 t -87.37 130.67 36.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 109.541 -0.54 . . . . 10.0 109.541 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.8 mm -102.41 114.61 42.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.893 0.378 . . . . 10.0 110.438 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.17 175.38 54.65 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.801 -0.636 . . . . 10.0 112.705 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.7 tp60 -61.42 -29.5 69.98 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 122.57 0.348 . . . . 10.0 111.66 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -97.64 18.97 14.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.817 0.342 . . . . 10.0 110.581 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.3 m 70.37 24.36 4.71 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.469 -0.787 . . . . 10.0 111.893 179.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 p -72.25 137.38 46.76 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.835 -0.432 . . . . 10.0 109.835 179.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.473 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 16.7 mt-10 -100.4 107.08 18.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.182 0.515 . . . . 10.0 110.296 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.41 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 3.6 mm -97.38 118.93 44.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.384 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.437 ' CD2' ' HG2' ' A' ' 25' ' ' LYS . 41.9 m80 -96.35 96.21 8.59 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.994 0.426 . . . . 10.0 110.061 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.4 116.18 28.44 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.311 -0.404 . . . . 10.0 109.939 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -87.32 103.37 15.41 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.09 -0.505 . . . . 10.0 109.859 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.464 HG12 HD11 ' A' ' 47' ' ' LEU . 2.6 m -108.76 169.88 3.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.043 0.449 . . . . 10.0 111.743 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -117.79 143.41 46.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.096 -0.502 . . . . 10.0 109.836 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 54.3 tpp -78.23 65.26 3.54 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.372 0.606 . . . . 10.0 110.199 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 78.6 m -164.04 -46.81 0.03 OUTLIER 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.617 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.29 147.17 52.56 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.427 -0.806 . . . . 10.0 111.611 -179.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 43.6 m80 -75.31 151.89 38.24 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.659 -0.496 . . . . 10.0 109.659 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.7 mt -70.95 -10.74 60.23 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.455 -0.339 . . . . 10.0 111.492 -179.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.59 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 41.8 tttp -63.06 -47.91 80.95 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.978 -0.379 . . . . 10.0 109.978 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -56.28 -40.61 74.54 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.948 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.464 HD11 HG12 ' A' ' 38' ' ' VAL . 3.6 mm? -64.03 -40.67 96.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.781 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -66.75 -47.25 72.84 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.923 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -69.81 -36.11 75.36 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.045 0.387 . . . . 10.0 112.045 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 49.4 m -75.59 -29.98 59.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.628 0.251 . . . . 10.0 111.397 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -65.14 -36.38 84.08 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.966 0.412 . . . . 10.0 110.512 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 63.2 m -60.02 -31.69 70.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.673 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -69.96 -31.25 68.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.901 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -67.76 -37.19 81.78 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.679 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -89.27 -14.32 36.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.352 -0.386 . . . . 10.0 111.269 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.94 36.14 29.16 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.896 -0.669 . . . . 10.0 112.392 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.1 m -123.71 159.78 54.21 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 110.561 -0.163 . . . . 10.0 110.561 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -68.27 167.22 22.73 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.221 1.947 . . . . 10.0 111.733 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.46 140.23 57.08 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.209 -179.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.8 t30 69.83 22.17 6.08 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.251 -0.886 . . . . 10.0 112.632 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.9 p -87.82 -23.17 24.11 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.44 0.638 . . . . 10.0 109.358 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 37.2 mt -117.69 134.98 54.33 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.372 -0.831 . . . . 10.0 109.786 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.429 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.2 ptt-85 -104.03 127.27 51.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.121 0.486 . . . . 10.0 110.393 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.458 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 87.4 m-85 -90.13 123.71 34.2 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.475 -0.784 . . . . 10.0 109.983 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.3 mt -110.51 118.35 36.01 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.106 0.479 . . . . 10.0 111.019 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -125.61 116.28 21.47 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.353 -0.84 . . . . 10.0 108.793 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 64.9 25.3 12.78 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.125 0.488 . . . . 10.0 110.737 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.19 -9.63 76.18 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.722 -0.672 . . . . 10.0 112.909 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -107.14 145.27 32.73 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 122.649 -0.324 . . . . 10.0 110.389 -179.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.458 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 14.2 ptm180 -82.5 137.03 34.74 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.234 0.54 . . . . 10.0 110.706 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.2 mm -71.64 119.92 18.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.848 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -74.32 164.22 26.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.427 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.59 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 0.1 OUTLIER -78.34 -1.8 35.04 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.985 0.421 . . . . 10.0 111.501 -179.016 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -121.87 16.1 10.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.254 0.55 . . . . 10.0 110.301 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -84.13 148.11 26.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.238 -179.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.555 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.3 OUTLIER -119.24 145.31 38.12 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.516 -0.765 . . . . 10.0 109.465 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . 0.462 ' HD2' HG22 ' A' ' 76' ' ' THR . 31.2 Cg_exo -60.42 -16.07 39.58 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.415 2.076 . . . . 10.0 112.574 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -69.35 -42.86 74.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.741 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 76' ' ' THR . 8.8 pt-20 -84.25 177.26 8.26 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.432 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 11.0 mt 72.94 -54.62 0.69 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.1 0.56 . . . . 10.0 110.773 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 119.2 64.13 0.28 Allowed Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.976 -0.63 . . . . 10.0 112.652 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 47.9 mtt -97.79 135.04 40.13 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.828 0.347 . . . . 10.0 110.586 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 4.9 mm-40 -133.19 -176.29 4.08 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.2 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 38.8 tp10 -71.09 139.71 50.44 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.663 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 65.65 25.42 11.58 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.209 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -72.27 156.74 38.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.44 -0.345 . . . . 10.0 110.242 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.5 t -111.45 130.94 64.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.894 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.445 HD11 ' HB3' ' A' ' 64' ' ' PHE . 18.0 tt -137.15 142.31 37.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -102.35 150.69 23.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.89 0.376 . . . . 10.0 111.451 -178.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -131.61 124.61 54.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.877 -0.602 . . . . 10.0 109.533 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -127.36 158.16 38.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.425 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -87.63 130.92 34.61 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.865 0.364 . . . . 10.0 111.636 -178.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.429 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 6.4 mm-40 -71.9 143.5 49.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.879 -0.601 . . . . 10.0 109.97 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -68.32 -25.69 65.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.059 -0.519 . . . . 10.0 111.493 -179.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 32.5 p -71.88 -28.47 63.54 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.937 0.398 . . . . 10.0 110.967 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 80.61 10.4 85.27 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.937 -0.649 . . . . 10.0 111.98 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.949 0 CA-C-O 118.84 -0.978 . . . . 10.0 111.322 -179.862 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 55.7 t30 . . . . . 0 N--CA 1.483 1.186 0 CA-C-O 121.134 0.493 . . . . 10.0 110.26 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 50.1 t30 -120.69 123.76 43.52 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.557 -0.905 . . . . 10.0 108.557 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -125.91 127.08 45.44 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . 0.427 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 20.6 t0 -122.71 128.7 25.3 Favored Pre-proline 0 C--N 1.318 -0.776 0 N-CA-C 107.394 -1.336 . . . . 10.0 107.394 176.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 57.9 Cg_endo -111.14 128.79 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.184 0 C-N-CA 121.728 1.619 . . . . 10.0 113.638 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.2 mt -119.67 136.93 55.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 113.702 -1.59 . . . . 10.0 109.732 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -113.07 135.77 51.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.394 0.616 . . . . 10.0 109.643 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 5.2 tp . . . . . 0 C--N 1.324 -0.53 0 CA-C-N 115.272 -0.876 . . . . 10.0 111.765 -176.366 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 110.126 -0.324 . . . . 10.0 110.126 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.422 ' HB ' HG22 ' A' ' 38' ' ' VAL . 31.6 mm -102.79 108.98 25.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.431 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -93.87 96.3 9.65 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.207 0.527 . . . . 10.0 110.61 -179.301 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 45.0 mt -82.23 149.83 27.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.614 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -105.82 107.89 19.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.24 -0.437 . . . . 10.0 110.201 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.497 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.8 t -89.3 121.83 39.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.371 -0.603 . . . . 10.0 109.371 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.0 mm -86.83 110.85 20.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.904 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.82 159.77 44.26 Favored Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 120.871 -0.68 . . . . 10.0 111.553 179.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -62.68 -32.23 73.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.737 0.269 . . . . 10.0 111.525 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -91.75 27.65 2.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.883 0.373 . . . . 10.0 111.342 -179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.9 m 62.56 37.95 12.76 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.777 -0.647 . . . . 10.0 111.179 179.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.85 143.53 26.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.855 -0.611 . . . . 10.0 109.916 179.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.455 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 20.9 mt-10 -109.14 97.43 7.04 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.114 0.483 . . . . 10.0 110.654 -179.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.497 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 3.0 mm -87.28 127.06 40.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.907 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -103.22 102.6 12.59 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.021 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.19 116.39 30.31 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.7 ttmt -87.44 95.13 9.9 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.76 -0.655 . . . . 10.0 109.611 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.429 HG12 HD11 ' A' ' 47' ' ' LEU . 3.1 m -101.06 163.95 2.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.461 . . . . 10.0 111.516 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -113.83 142.4 46.14 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.869 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.405 ' O ' ' HB ' ' A' ' 41' ' ' THR . 54.3 tpp -80.42 76.8 7.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.999 0.428 . . . . 10.0 111.663 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.405 ' HB ' ' O ' ' A' ' 40' ' ' MET . 8.3 t 173.68 -35.54 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.883 178.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.21 132.65 42.37 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.14 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.7 m80 -64.69 155.95 31.85 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.034 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.402 HD12 ' HB3' ' A' ' 75' ' ' HIS . 48.3 mt -74.51 -0.9 19.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.737 0.303 . . . . 10.0 110.687 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.537 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 12.2 tptp -59.62 -57.33 13.42 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.403 ' HG3' HD11 ' B' ' 364' ' ' ILE . 4.7 tppp? -59.15 -35.39 73.42 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.482 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.429 HD11 HG12 ' A' ' 38' ' ' VAL . 4.3 mm? -64.67 -48.16 75.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.044 -0.525 . . . . 10.0 111.679 -179.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -58.39 -48.46 80.58 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.951 0.352 . . . . 10.0 111.951 -179.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 4.6 pt-20 -70.58 -31.37 68.35 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.015 0.376 . . . . 10.0 112.015 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.0 m -71.95 -36.91 70.01 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.942 -0.303 . . . . 10.0 110.974 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -64.98 -39.34 93.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.852 0.358 . . . . 10.0 110.092 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.419 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 58.6 m -62.1 -36.08 80.64 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 178.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -66.85 -39.12 87.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.348 179.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -63.38 -41.23 98.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.616 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -78.2 -16.42 57.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.817 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.03 31.83 41.81 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.888 -0.672 . . . . 10.0 112.431 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.7 m -128.34 158.06 72.61 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 110.648 -0.13 . . . . 10.0 110.648 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -64.98 161.62 36.02 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.37 2.046 . . . . 10.0 111.311 178.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.419 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 21.6 ttt -72.22 152.25 42.34 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.038 -0.265 . . . . 10.0 111.124 -179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 11.7 t30 79.13 -3.57 2.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.024 0.93 . . . . 10.0 111.924 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 81.1 p -78.28 -18.23 55.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.255 0.55 . . . . 10.0 109.795 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 56.9 mt -120.84 135.35 55.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.16 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.501 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 10.7 ptt180 -105.38 125.28 50.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.045 0.45 . . . . 10.0 110.323 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -88.28 117.59 27.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.885 179.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.3 mt -107.52 123.6 48.67 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.123 0.487 . . . . 10.0 110.346 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -127.27 98.61 5.34 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.582 -0.735 . . . . 10.0 109.839 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 62.29 49.13 4.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.279 -0.873 . . . . 10.0 111.351 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.02 -50.87 2.51 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.962 -0.637 . . . . 10.0 113.49 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -80.38 163.19 24.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.868 0.366 . . . . 10.0 111.34 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -101.91 152.4 20.96 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.375 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 46.2 mm -82.33 121.26 35.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.96 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -79.56 163.78 24.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.994 -0.548 . . . . 10.0 109.883 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.67 -21.0 61.14 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.837 0.351 . . . . 10.0 111.706 -179.204 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -100.83 5.37 43.43 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.697 -0.228 . . . . 10.0 111.235 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.402 ' HB3' HD12 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -74.65 149.03 40.15 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.599 -179.645 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 23.9 p -123.23 157.42 61.22 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.109 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -69.0 -8.06 22.55 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.514 2.143 . . . . 10.0 112.253 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -79.25 -35.97 40.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.773 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.473 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 7.8 pt-20 -92.21 173.03 8.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.037 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.473 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 52.2 mt 73.78 -42.39 0.51 Allowed 'General case' 0 N--CA 1.469 0.519 0 O-C-N 123.692 0.62 . . . . 10.0 110.947 -179.204 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 105.41 84.95 1.79 Allowed Glycine 0 N--CA 1.444 -0.824 0 C-N-CA 121.174 -0.536 . . . . 10.0 112.362 179.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 52.5 mtt -114.88 148.26 38.84 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.847 -0.427 . . . . 10.0 109.847 179.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.9 mm-40 -146.12 174.67 11.1 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.954 0.406 . . . . 10.0 110.971 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.431 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 20.7 tp10 -65.9 135.5 54.86 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.896 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 18.5 mm-40 69.26 25.65 5.58 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 123.574 0.546 . . . . 10.0 111.558 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.3 t0 -71.92 167.2 20.57 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.824 -0.351 . . . . 10.0 110.091 179.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.0 t -113.9 117.57 55.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 120.912 0.387 . . . . 10.0 111.836 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 16.9 tt -125.72 139.54 51.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.812 -0.631 . . . . 10.0 109.32 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -113.25 146.63 39.03 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.865 0.364 . . . . 10.0 111.1 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.2 p -133.92 130.76 55.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.145 -0.48 . . . . 10.0 109.811 179.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -134.49 166.6 22.5 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.34 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -76.29 141.47 41.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.685 0.278 . . . . 10.0 110.813 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.501 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 1.1 mm-40 -86.41 151.27 23.68 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.368 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -72.61 -22.08 61.01 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.231 0.539 . . . . 10.0 110.262 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -30.79 69.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.585 -0.734 . . . . 10.0 110.843 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 88.08 -9.99 72.58 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.892 -0.67 . . . . 10.0 113.051 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.837 0 CA-C-O 118.492 -1.171 . . . . 10.0 111.633 -179.807 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 121.075 0.464 . . . . 10.0 110.599 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -119.7 122.51 41.64 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.607 -0.437 . . . . 10.0 109.88 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . 0.455 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 14.7 ptt180 -124.94 128.59 48.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.247 0.546 . . . . 10.0 112.309 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . 0.425 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 32.4 t0 -123.41 128.57 25.19 Favored Pre-proline 0 C--N 1.32 -0.708 0 N-CA-C 107.601 -1.259 . . . . 10.0 107.601 177.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 67.3 Cg_endo -107.91 127.61 0.05 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 121.545 1.497 . . . . 10.0 112.868 -179.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 3.0 mt -117.9 136.96 53.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 114.364 -1.289 . . . . 10.0 110.186 -178.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 40.7 t -112.54 135.57 51.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.477 0.656 . . . . 10.0 110.312 -178.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . 0.403 HD11 ' HG3' ' A' ' 46' ' ' LYS . 7.9 tp . . . . . 0 C--N 1.321 -0.633 0 CA-C-N 114.444 -1.253 . . . . 10.0 110.729 -177.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.688 0.28 . . . . 10.0 110.357 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.1 mm -100.95 116.84 45.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.634 ' HE2' ' ND1' ' A' ' 35' ' ' HIS . 0.4 OUTLIER -100.43 105.56 17.05 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.119 0.485 . . . . 10.0 110.763 -179.481 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.8 mt -88.57 150.85 22.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.21 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 44.1 mtpt -110.19 119.59 39.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.0 0.429 . . . . 10.0 110.454 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.7 t -102.11 131.35 50.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.712 -0.677 . . . . 10.0 109.44 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.8 mm -101.33 118.31 47.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.899 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.4 155.81 25.36 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.981 -0.628 . . . . 10.0 112.153 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -65.79 -20.73 66.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.008 0.432 . . . . 10.0 111.053 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -89.84 12.59 16.81 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.777 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.9 m 71.22 39.58 0.94 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.533 -0.758 . . . . 10.0 111.578 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 20.7 p -102.84 140.52 37.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.243 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -107.91 99.46 8.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.121 0.486 . . . . 10.0 109.985 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.0 mm -89.04 134.22 29.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.151 -178.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.634 ' ND1' ' HE2' ' A' ' 23' ' ' LYS . 97.5 m-70 -111.44 105.97 14.74 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.603 -0.518 . . . . 10.0 109.603 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -104.02 117.62 34.73 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.875 0.369 . . . . 10.0 110.487 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.9 ttmt -89.58 100.5 13.29 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.119 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 m -103.2 170.18 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.515 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -121.2 142.73 49.62 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 110.079 -0.341 . . . . 10.0 110.079 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.467 ' O ' ' HB ' ' A' ' 41' ' ' THR . 48.7 tpp -74.96 71.39 2.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.442 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.467 ' HB ' ' O ' ' A' ' 40' ' ' MET . 10.1 t 171.86 -29.96 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.278 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.08 139.48 44.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.205 -179.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -68.02 137.57 55.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.231 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.477 HD12 ' HB3' ' A' ' 75' ' ' HIS . 63.9 mt -68.08 -9.23 44.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.347 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.0 tptt -58.53 -47.1 85.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.297 0.57 . . . . 10.0 109.471 178.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -65.42 -34.46 78.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.236 -0.893 . . . . 10.0 110.539 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.414 HD13 ' HA ' ' A' ' 47' ' ' LEU . 4.3 mm? -68.66 -45.32 72.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.822 -0.626 . . . . 10.0 111.173 -179.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -61.56 -45.67 93.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.812 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.433 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 11.1 pt-20 -70.08 -40.27 75.09 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.937 -0.305 . . . . 10.0 111.371 -179.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.3 m -61.91 -34.82 76.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.818 0.342 . . . . 10.0 110.772 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -65.79 -40.73 92.24 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.673 -0.492 . . . . 10.0 109.673 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 57.9 m -63.92 -39.78 94.95 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.255 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 49' ' ' GLU . 79.7 mt-30 -65.26 -41.62 94.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.411 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -64.77 -37.45 87.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.938 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.424 ' HB2' HG22 ' A' ' 57' ' ' VAL . 15.0 mm100 -85.75 -3.32 58.87 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.03 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.3 39.65 98.08 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.234 -0.507 . . . . 10.0 112.516 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.424 HG22 ' HB2' ' A' ' 55' ' ' GLN . 4.3 m -124.14 156.2 66.69 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.474 ' HG2' ' HB3' ' A' ' 61' ' ' SER . 11.0 Cg_endo -58.36 165.41 7.48 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.697 2.264 . . . . 10.0 112.431 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 22.4 ttt -69.1 132.28 46.33 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.617 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.0 t30 66.29 25.5 10.49 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.271 -0.877 . . . . 10.0 111.996 179.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.474 ' HB3' ' HG2' ' A' ' 58' ' ' PRO . 12.6 p -77.32 -22.32 52.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.564 0.697 . . . . 10.0 109.816 178.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.9 mt -117.92 141.59 48.27 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.082 -0.963 . . . . 10.0 110.372 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.441 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 20.5 ptt-85 -104.87 128.7 53.17 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.751 178.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -94.5 123.97 38.24 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.163 -0.472 . . . . 10.0 110.014 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.7 mt -112.26 121.6 45.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.894 -179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -124.15 113.56 18.5 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.365 -0.834 . . . . 10.0 108.866 178.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.401 ' OE1' ' HA ' ' A' ' 67' ' ' GLU . 4.1 mm-40 63.12 28.75 16.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.253 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 88.0 -4.89 85.47 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 121.088 -0.577 . . . . 10.0 113.126 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -109.33 145.96 35.15 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.948 -0.39 . . . . 10.0 109.948 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -85.86 139.54 31.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.194 0.521 . . . . 10.0 110.795 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.5 mm -74.91 121.5 26.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.881 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -75.29 164.39 26.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.014 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.87 -27.09 60.11 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.698 0.285 . . . . 10.0 111.089 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 -99.99 22.88 10.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.962 0.411 . . . . 10.0 110.562 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.477 ' HB3' HD12 ' A' ' 44' ' ' LEU . 1.5 m170 -85.03 157.05 20.85 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.109 0.481 . . . . 10.0 111.309 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.548 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.2 OUTLIER -134.56 152.3 77.55 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.742 179.108 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -63.11 -13.15 33.67 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.583 2.189 . . . . 10.0 113.013 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.0 tppt? -69.63 -40.98 76.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.441 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.548 ' HG2' ' O ' ' A' ' 76' ' ' THR . 7.6 pt-20 -85.36 169.01 14.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.095 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 22.8 mt 73.78 -60.06 0.54 Allowed 'General case' 0 N--CA 1.468 0.427 0 O-C-N 123.828 0.705 . . . . 10.0 110.599 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 119.79 76.76 0.49 Allowed Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.936 -0.65 . . . . 10.0 112.177 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 65.1 mtt -104.08 118.04 35.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.726 0.298 . . . . 10.0 110.489 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.452 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 17.4 mm-40 -112.51 -177.67 3.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.663 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.49 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 38.6 tp10 -73.85 140.62 45.86 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.224 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 20.3 mm-40 70.49 20.79 5.8 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.638 0.586 . . . . 10.0 111.009 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.6 OUTLIER -71.98 150.24 44.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.077 179.568 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 40.2 t -109.4 122.28 63.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.079 0.466 . . . . 10.0 111.572 -178.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.8 tt -121.65 142.15 39.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -102.58 145.8 29.09 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.711 0.291 . . . . 10.0 111.353 -178.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.4 p -130.46 125.55 59.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.188 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -133.66 156.57 47.67 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.223 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.67 142.24 38.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.79 0.329 . . . . 10.0 111.219 -179.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.441 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.9 mm-40 -81.18 149.62 29.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.411 179.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -66.43 -37.15 84.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.106 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 6.4 p -76.38 -12.27 60.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.498 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 84.94 -10.22 63.54 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.835 -0.698 . . . . 10.0 112.092 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.939 0 N-CA-C 110.922 -0.871 . . . . 10.0 110.922 -179.834 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 . . . . . 0 N--CA 1.479 1.023 0 CA-C-O 121.359 0.599 . . . . 10.0 110.35 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -118.5 126.69 52.55 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 108.179 -1.045 . . . . 10.0 108.179 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -124.86 128.07 48.11 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 113.162 0.801 . . . . 10.0 113.162 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -124.0 127.43 25.39 Favored Pre-proline 0 C--N 1.314 -0.943 0 N-CA-C 107.429 -1.323 . . . . 10.0 107.429 175.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -109.81 127.85 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.22 0 C-N-CA 121.779 1.652 . . . . 10.0 113.021 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.5 mt -118.64 136.01 57.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 114.182 -1.372 . . . . 10.0 110.056 -179.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 13.6 t -113.02 137.2 46.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 108.972 -0.751 . . . . 10.0 108.972 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . 0.409 ' HA ' HD12 ' B' ' 364' ' ' ILE . 6.4 tp . . . . . 0 C--N 1.316 -0.884 0 CA-C-N 114.867 -1.061 . . . . 10.0 111.696 -176.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.3 mm -105.48 114.01 43.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.379 -0.6 . . . . 10.0 109.379 179.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.436 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.7 ttpm? -99.62 103.05 14.73 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.029 0.442 . . . . 10.0 110.506 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 21.8 mt -88.2 153.13 21.48 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.716 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.9 mtpt -107.41 111.15 23.33 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.297 -0.41 . . . . 10.0 109.982 179.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.433 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.6 t -95.41 125.82 48.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.874 -0.603 . . . . 10.0 109.62 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.1 mm -95.83 118.87 43.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 120.966 0.413 . . . . 10.0 110.63 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.76 164.75 36.03 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.815 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -62.27 -27.96 69.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.651 0.263 . . . . 10.0 111.378 -179.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -91.56 24.4 3.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.451 -0.34 . . . . 10.0 110.808 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.1 m 61.83 38.37 14.77 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.873 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -93.33 145.02 24.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.969 -0.56 . . . . 10.0 109.831 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.501 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 4.3 mt-10 -113.48 98.42 7.07 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.228 0.537 . . . . 10.0 110.337 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.433 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 3.8 mm -87.13 128.13 40.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.723 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.9 m170 -99.13 94.58 6.58 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.633 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.75 113.31 25.35 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.833 0.349 . . . . 10.0 110.21 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -92.68 103.93 16.26 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.418 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 m -104.38 170.15 2.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.871 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -119.0 139.99 50.77 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 56.8 tpp -76.81 62.7 2.08 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.167 0.508 . . . . 10.0 110.379 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 m -163.15 -38.19 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.219 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.85 152.24 28.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.721 -0.672 . . . . 10.0 112.172 -178.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -80.67 152.69 28.32 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.551 -0.749 . . . . 10.0 109.536 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.9 mt -69.66 -6.7 33.24 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.813 0.301 . . . . 10.0 111.813 -179.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.418 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 50.0 tptt -60.15 -51.31 70.14 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.827 -0.434 . . . . 10.0 109.827 178.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.424 ' HG3' HD11 ' B' ' 364' ' ' ILE . 4.8 tppp? -62.63 -33.51 75.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.539 -0.755 . . . . 10.0 110.651 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.51 -47.13 67.78 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.07 -0.514 . . . . 10.0 111.57 -179.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -61.82 -45.19 94.92 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.07 0.396 . . . . 10.0 112.07 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 9.8 pt-20 -68.78 -35.14 76.68 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.75 0.278 . . . . 10.0 111.75 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 64.6 m -68.68 -33.02 73.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.755 0.312 . . . . 10.0 110.712 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.432 ' CG ' ' HZ ' ' A' ' 64' ' ' PHE . 30.5 t80 -68.54 -42.25 78.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.937 0.398 . . . . 10.0 110.185 179.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 56.0 m -60.91 -41.82 96.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.954 -0.567 . . . . 10.0 110.216 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -67.08 -30.76 70.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.79 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -69.47 -39.71 77.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.651 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -82.26 -15.75 51.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.216 -179.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.07 39.15 10.32 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.653 -0.784 . . . . 10.0 112.387 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.2 m -135.85 153.49 77.19 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 110.08 -0.341 . . . . 10.0 110.08 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -66.29 159.1 51.64 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.232 1.954 . . . . 10.0 111.103 178.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.41 ' SD ' ' HB3' ' A' ' 49' ' ' GLU . 17.2 ttt -68.03 159.53 30.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.714 0.292 . . . . 10.0 111.252 -179.265 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.0 t30 79.7 -16.9 0.62 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.163 0.985 . . . . 10.0 111.743 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 81.0 p -68.49 -37.73 80.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.122 0.487 . . . . 10.0 110.026 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 94.1 mt -102.6 125.33 49.29 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.577 -0.738 . . . . 10.0 110.308 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.504 ' HD3' ' OE2' ' A' ' 93' ' ' GLU . 18.2 ptt180 -106.18 124.78 50.12 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.145 0.498 . . . . 10.0 110.417 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.432 ' HZ ' ' CG ' ' A' ' 51' ' ' TYR . 50.7 m-85 -86.51 126.61 34.56 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.483 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 82.5 mt -113.43 127.7 56.2 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.174 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -135.38 115.72 13.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.464 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 62.3 29.36 17.32 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.529 0.518 . . . . 10.0 110.925 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.32 -37.23 3.48 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.967 -0.635 . . . . 10.0 112.885 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -81.02 158.72 25.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.7 0.286 . . . . 10.0 110.621 -179.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.0 ptm180 -96.54 140.66 30.84 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.979 0.419 . . . . 10.0 110.174 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.0 mm -74.15 123.95 30.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.414 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.58 166.9 17.82 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.51 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -81.08 -3.25 51.29 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.933 -178.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.7 p-10 -115.88 4.79 13.93 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.841 0.353 . . . . 10.0 110.624 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 21.5 m170 -78.45 152.57 32.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.398 -179.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.495 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 11.2 p -123.41 153.98 65.75 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.172 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -66.6 -14.28 43.35 Favored 'Trans proline' 0 N--CA 1.472 0.236 0 C-N-CA 122.484 2.123 . . . . 10.0 112.639 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -73.93 -30.65 62.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.538 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 76' ' ' THR . 13.9 pt-20 -98.6 173.49 6.9 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.738 -0.467 . . . . 10.0 109.738 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.432 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 58.4 mt 73.01 -46.96 0.66 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 123.634 0.584 . . . . 10.0 111.235 -179.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 112.4 77.03 0.81 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 121.092 -0.575 . . . . 10.0 112.732 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 56.5 mtt -111.67 115.72 29.59 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.748 0.308 . . . . 10.0 110.35 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 25.1 mm-40 -114.35 177.62 4.58 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.069 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.439 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 29.1 tp10 -69.7 139.11 53.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.076 179.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 13.1 mm-40 70.57 11.85 7.32 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 123.483 0.49 . . . . 10.0 111.927 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.3 OUTLIER -68.8 147.61 51.51 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.97 -0.292 . . . . 10.0 110.309 179.705 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 92.6 t -98.1 126.39 51.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 121.241 0.543 . . . . 10.0 111.59 -178.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.5 tt -126.39 142.9 41.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.53 -0.759 . . . . 10.0 109.136 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -108.18 157.21 18.51 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.101 0.477 . . . . 10.0 111.841 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.4 p -146.85 125.39 4.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.436 178.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -133.98 169.38 17.2 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.387 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -81.58 134.65 35.52 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.848 0.356 . . . . 10.0 110.965 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.504 ' OE2' ' HD3' ' A' ' 63' ' ' ARG . 2.6 mm-40 -69.42 173.91 5.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.565 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -78.44 -31.35 48.01 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.921 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 16.6 p -72.46 -33.32 66.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.568 -0.742 . . . . 10.0 111.321 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.78 6.32 80.03 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 110.96 -0.856 . . . . 10.0 110.96 -178.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.978 0 N-CA-C 110.716 -0.953 . . . . 10.0 110.716 -179.788 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 66.3 t30 . . . . . 0 N--CA 1.483 1.177 0 CA-C-O 121.283 0.563 . . . . 10.0 110.988 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . 0.501 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 5.9 t-20 -120.34 121.09 37.83 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 108.468 -0.938 . . . . 10.0 108.468 178.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . 0.44 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 16.8 ptt180 -128.66 129.57 46.02 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 113.327 0.862 . . . . 10.0 113.327 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -122.54 130.44 24.66 Favored Pre-proline 0 C--N 1.317 -0.823 0 N-CA-C 107.872 -1.159 . . . . 10.0 107.872 176.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -108.36 127.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 121.246 1.297 . . . . 10.0 113.719 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.2 mt -119.26 135.08 60.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 114.407 -1.27 . . . . 10.0 109.93 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 21.0 t -114.49 135.24 54.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 N-CA-C 109.014 -0.735 . . . . 10.0 109.014 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . 0.424 HD11 ' HG3' ' A' ' 46' ' ' LYS . 6.5 tp . . . . . 0 C--N 1.315 -0.893 0 CA-C-N 115.082 -0.963 . . . . 10.0 111.502 -176.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 110.382 -0.229 . . . . 10.0 110.382 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.5 mm -110.95 118.87 58.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -100.4 108.71 20.78 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.119 0.485 . . . . 10.0 111.624 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.8 mt -91.46 147.66 22.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.546 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt -105.25 104.58 14.33 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.077 0.465 . . . . 10.0 110.363 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.45 ' O ' HG12 ' A' ' 34' ' ' ILE . 3.6 t -87.77 125.97 41.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.685 -0.689 . . . . 10.0 109.369 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.6 mm -99.44 116.05 41.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 120.888 0.375 . . . . 10.0 110.575 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.84 169.66 42.81 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.719 -0.753 . . . . 10.0 111.93 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -60.02 -33.17 71.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.357 . . . . 10.0 111.486 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -86.69 23.25 1.72 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.572 -179.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 72.2 m 61.37 32.21 19.13 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.259 0.552 . . . . 10.0 111.066 179.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.03 140.1 31.28 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.73 -0.668 . . . . 10.0 109.714 179.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.491 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 12.8 mt-10 -107.62 96.47 6.42 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.106 0.479 . . . . 10.0 110.251 -179.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 26' ' ' VAL . 1.2 mm -82.66 127.44 39.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.657 -179.169 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -96.17 87.68 4.6 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.36 106.26 17.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.336 -179.251 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -92.2 104.69 17.03 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.946 0.403 . . . . 10.0 110.701 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 5.1 m -103.45 167.16 2.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.202 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 64.8 tttt -117.31 137.8 52.19 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 110.164 -0.31 . . . . 10.0 110.164 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.438 ' O ' ' HB ' ' A' ' 41' ' ' THR . 57.6 tpp -75.11 76.13 2.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.014 0.435 . . . . 10.0 110.711 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.438 ' HB ' ' O ' ' A' ' 40' ' ' MET . 8.7 t 173.13 -30.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.127 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.67 145.86 28.56 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.406 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -76.43 147.32 38.03 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.189 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.416 HD12 ' HB3' ' A' ' 75' ' ' HIS . 49.2 mt -69.02 -7.33 34.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.951 0.405 . . . . 10.0 110.657 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 28.2 tptt -56.15 -52.58 63.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.24 178.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.404 ' HG2' HD11 ' B' ' 364' ' ' ILE . 23.4 ttpt -69.9 -32.83 71.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.685 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.473 ' HA ' HD13 ' A' ' 47' ' ' LEU . 3.3 mm? -63.87 -39.47 94.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.273 -0.421 . . . . 10.0 111.045 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -61.69 -44.27 97.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.67 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -76.03 -28.67 57.81 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 121.017 -0.273 . . . . 10.0 111.368 -179.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.411 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 66.4 m -63.24 -38.7 92.18 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.952 0.406 . . . . 10.0 111.008 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -67.07 -35.33 79.59 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.898 -0.408 . . . . 10.0 109.898 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.474 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.9 m -62.19 -40.57 96.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.736 -0.666 . . . . 10.0 109.895 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.411 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.3 mt-30 -64.21 -41.08 97.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.527 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -66.95 -32.41 73.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.176 -0.466 . . . . 10.0 110.678 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -84.84 -11.85 54.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.129 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.93 32.31 63.69 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.994 -0.622 . . . . 10.0 112.266 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.9 m -131.37 154.59 81.96 Favored Pre-proline 0 C--N 1.324 -0.543 0 N-CA-C 110.54 -0.171 . . . . 10.0 110.54 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -64.27 164.29 23.37 Favored 'Trans proline' 0 CA--C 1.53 0.277 0 C-N-CA 122.449 2.099 . . . . 10.0 111.577 178.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.474 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 11.6 ttt -72.61 157.83 36.82 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 121.236 -0.186 . . . . 10.0 110.934 -179.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.3 t30 75.12 5.35 4.25 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.525 0.73 . . . . 10.0 111.947 178.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 55.6 p -86.69 -26.36 24.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.371 0.605 . . . . 10.0 109.926 179.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 48.7 mt -117.35 143.23 46.18 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.406 -0.815 . . . . 10.0 110.678 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.522 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 14.2 ptt-85 -115.42 127.7 55.54 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.284 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.459 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 25.3 m-85 -90.37 121.72 32.61 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.061 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 55.4 mt -107.94 111.44 23.54 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.128 0.489 . . . . 10.0 110.709 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -121.7 121.84 38.23 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.409 -0.814 . . . . 10.0 109.022 179.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 63.2 19.34 11.61 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.434 0.459 . . . . 10.0 110.962 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.62 -21.86 43.88 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.925 -0.655 . . . . 10.0 112.585 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -98.14 161.23 13.82 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.572 0.225 . . . . 10.0 110.636 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.459 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 13.3 ptm180 -95.46 143.45 26.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.017 0.437 . . . . 10.0 110.698 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.3 mm -77.95 127.36 38.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.646 -0.706 . . . . 10.0 111.803 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.94 166.44 13.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.33 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.479 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -73.35 -13.64 61.14 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.659 0.266 . . . . 10.0 111.521 -179.284 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -105.64 10.7 32.84 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.791 0.329 . . . . 10.0 111.229 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.416 ' HB3' HD12 ' A' ' 44' ' ' LEU . 1.6 m170 -83.65 149.03 26.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.102 0.477 . . . . 10.0 111.124 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.421 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -129.42 148.09 67.82 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.692 178.888 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 76' ' ' THR . 24.3 Cg_exo -64.32 -6.69 12.21 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.718 2.279 . . . . 10.0 112.798 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.9 tppt? -75.15 -27.27 59.65 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.902 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 76' ' ' THR . 3.2 pt-20 -108.69 -174.99 2.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.556 -179.397 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 41.0 mt 72.17 -58.49 0.59 Allowed 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.894 0.746 . . . . 10.0 110.922 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 129.36 61.16 0.1 Allowed Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 111.693 -0.563 . . . . 10.0 111.693 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 39.8 mtt -98.16 126.22 43.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.935 0.398 . . . . 10.0 110.644 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.493 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -129.84 173.27 10.83 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.364 179.893 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -66.17 138.33 57.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.235 -0.439 . . . . 10.0 109.834 179.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 69.63 25.89 5.13 Favored 'General case' 0 C--O 1.233 0.198 0 O-C-N 123.65 0.594 . . . . 10.0 111.546 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.493 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.6 OUTLIER -74.5 146.33 42.81 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 179.19 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 41.6 t -99.48 126.07 52.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.03 0.443 . . . . 10.0 111.186 -179.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.7 tt -135.36 143.01 38.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.971 -0.559 . . . . 10.0 109.683 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -110.47 153.62 24.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.018 0.437 . . . . 10.0 110.848 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.9 p -132.42 129.61 59.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.624 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -125.32 165.21 18.77 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.474 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -91.03 132.92 35.71 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.293 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.522 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.9 mm-40 -77.17 152.82 34.66 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.85 0.357 . . . . 10.0 110.807 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -77.64 -14.43 59.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.301 0.572 . . . . 10.0 110.024 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.6 p -71.36 -43.73 66.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.53 -0.759 . . . . 10.0 110.706 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 102.9 -16.21 54.62 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.989 -0.625 . . . . 10.0 112.324 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.933 0 CA-C-O 118.897 -0.946 . . . . 10.0 111.337 -179.617 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 . . . . . 0 N--CA 1.484 1.225 0 CA-C-O 121.044 0.45 . . . . 10.0 110.837 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -120.29 123.13 42.4 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.509 -0.923 . . . . 10.0 108.509 178.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . 0.491 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 27.4 ptt180 -126.25 127.86 46.28 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 119.904 -0.718 . . . . 10.0 111.922 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . 0.456 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 34.5 t70 -120.87 130.59 24.78 Favored Pre-proline 0 C--N 1.317 -0.819 0 N-CA-C 106.276 -1.749 . . . . 10.0 106.276 177.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 61.2 Cg_endo -108.05 129.22 0.05 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.281 0 C-N-CA 121.589 1.526 . . . . 10.0 114.005 -177.671 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 23.6 mt -119.08 132.09 69.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 CA-C-N 114.32 -1.309 . . . . 10.0 109.971 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 10.5 t -117.28 135.97 55.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 109.495 -0.557 . . . . 10.0 109.495 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . 0.421 HD12 ' HA ' ' B' ' 364' ' ' ILE . 5.4 tp . . . . . 0 C--N 1.312 -1.032 0 CA-C-N 114.93 -1.032 . . . . 10.0 110.945 -177.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 . . . . . 0 N--CA 1.482 1.167 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.4 mm -107.6 110.12 30.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.89 0.376 . . . . 10.0 110.089 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.423 ' NZ ' ' HB3' ' A' ' 23' ' ' LYS . 1.7 ttpm? -100.05 100.45 11.33 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.159 0.504 . . . . 10.0 110.513 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 33.3 mt -83.27 152.22 25.25 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.101 -179.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 40.4 mtpt -110.11 108.85 19.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.06 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.413 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.1 t -90.39 131.07 38.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.274 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.4 mm -89.98 110.83 22.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.464 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -76.14 152.9 42.57 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.846 -0.615 . . . . 10.0 112.172 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -61.88 -22.51 65.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.834 0.349 . . . . 10.0 111.553 -179.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -97.29 20.82 10.88 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.841 0.353 . . . . 10.0 110.569 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.2 m 67.42 44.94 1.67 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.605 -0.725 . . . . 10.0 111.128 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.8 p -107.3 149.74 27.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.634 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 10.0 mt-10 -107.5 101.95 11.26 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.41 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 5.6 mm -92.21 125.94 44.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.269 -179.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 23.5 m-70 -102.01 101.96 12.41 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.747 -0.464 . . . . 10.0 109.747 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.73 113.98 26.3 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.458 -179.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -85.7 99.51 11.36 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.867 -0.42 . . . . 10.0 109.867 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 m -106.13 168.88 2.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.996 -179.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.46 ' HE2' ' OG1' ' A' ' 41' ' ' THR . 79.1 tttt -120.0 143.2 48.18 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.855 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 58.9 tpp -76.74 58.56 1.44 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.347 0.594 . . . . 10.0 110.507 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.46 ' OG1' ' HE2' ' A' ' 39' ' ' LYS . 5.7 m -158.07 -42.11 0.06 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.513 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.3 147.94 37.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.837 -0.619 . . . . 10.0 111.251 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.462 ' HA ' HG22 ' A' ' 76' ' ' THR . 7.3 m80 -75.92 151.98 37.2 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.585 ' HA ' HD23 ' A' ' 47' ' ' LEU . 12.6 mt -66.33 -12.45 56.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.753 0.311 . . . . 10.0 111.36 -179.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 43.4 tptt -59.12 -44.4 92.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.156 0.503 . . . . 10.0 109.67 178.129 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -64.69 -32.72 74.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.204 -0.907 . . . . 10.0 110.655 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.585 HD23 ' HA ' ' A' ' 44' ' ' LEU . 2.5 mm? -74.96 -41.78 58.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.965 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -60.64 -47.71 85.04 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.898 -179.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -67.31 -46.73 72.65 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.946 0.35 . . . . 10.0 111.946 -178.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.7 m -61.09 -36.38 79.51 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.724 0.268 . . . . 10.0 111.724 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -64.65 -45.84 85.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.774 0.321 . . . . 10.0 110.465 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 60.3 m -59.93 -49.23 78.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.659 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -58.37 -39.88 80.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.128 0.489 . . . . 10.0 110.789 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -64.53 -39.58 94.03 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.154 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -80.3 -6.07 57.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.284 -0.416 . . . . 10.0 111.809 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.91 37.95 17.48 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.654 -0.784 . . . . 10.0 112.694 179.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -139.65 150.72 64.22 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 110.028 -0.36 . . . . 10.0 110.028 179.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.06 162.15 34.76 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.163 1.909 . . . . 10.0 111.424 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.495 ' HG3' ' N ' ' A' ' 60' ' ' ASN . 0.9 OUTLIER -62.84 147.83 48.91 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.893 -0.14 . . . . 10.0 110.637 179.431 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.495 ' N ' ' HG3' ' A' ' 59' ' ' MET . 35.7 t30 83.62 6.11 0.73 Allowed 'General case' 0 N--CA 1.475 0.823 0 O-C-N 124.069 0.856 . . . . 10.0 112.012 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 57.6 p -90.1 -33.88 16.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.041 0.448 . . . . 10.0 110.294 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 92' ' ' GLN . 33.6 mt -115.2 146.46 41.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.675 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.524 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 15.0 ptt-85 -117.02 135.64 53.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.217 179.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -93.98 127.23 39.64 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.169 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.0 mt -109.86 124.15 50.83 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.552 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -138.04 121.69 17.43 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.385 -0.825 . . . . 10.0 109.208 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 61.91 24.97 14.95 Favored 'General case' 0 C--N 1.331 -0.221 0 O-C-N 123.483 0.49 . . . . 10.0 110.989 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.63 2.0 87.2 Favored Glycine 0 CA--C 1.522 0.474 0 C-N-CA 121.115 -0.564 . . . . 10.0 113.07 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -114.19 164.93 13.21 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.945 0.372 . . . . 10.0 110.572 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -100.3 130.26 46.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.015 0.435 . . . . 10.0 110.217 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.9 mm -67.57 124.44 22.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.383 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -85.08 172.76 11.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.304 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 2.6 m-20 -80.88 -15.45 56.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.883 0.373 . . . . 10.0 111.205 -179.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -107.49 30.18 6.5 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.219 0.533 . . . . 10.0 110.577 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.412 ' HB3' HD12 ' A' ' 44' ' ' LEU . 2.6 m170 -104.47 152.62 22.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.972 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.462 HG22 ' HA ' ' A' ' 43' ' ' HIS . 6.1 p -130.1 153.81 81.17 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.966 178.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -62.88 -13.78 36.85 Favored 'Trans proline' 0 N--CA 1.475 0.414 0 C-N-CA 122.701 2.267 . . . . 10.0 112.865 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -72.35 -34.36 67.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.839 -179.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 76' ' ' THR . 6.0 pt-20 -94.72 174.34 7.16 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.935 -0.395 . . . . 10.0 109.935 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 15.9 mt 73.84 -41.38 0.48 Allowed 'General case' 0 N--CA 1.468 0.431 0 O-C-N 123.684 0.615 . . . . 10.0 111.249 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 107.79 56.32 0.6 Allowed Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.883 -0.675 . . . . 10.0 112.341 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 47.5 mtt -90.5 128.91 36.68 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.508 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.3 mm-40 -126.56 -179.91 5.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.089 0.471 . . . . 10.0 111.635 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -68.07 140.02 56.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.645 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 62.01 23.61 13.94 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.024 -0.535 . . . . 10.0 111.709 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.508 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.7 t0 -70.75 148.88 47.48 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.204 -0.198 . . . . 10.0 110.548 179.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 89.7 t -97.61 114.02 33.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.036 0.446 . . . . 10.0 111.59 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.413 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 18.8 tt -119.61 142.48 34.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -110.83 151.94 27.24 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.029 0.443 . . . . 10.0 111.636 -178.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.2 p -136.25 125.54 38.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.64 179.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -131.8 157.24 44.39 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.409 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.422 ' HA ' HD23 ' A' ' 62' ' ' LEU . 6.2 tt0 -75.97 138.89 41.24 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.904 0.383 . . . . 10.0 110.845 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.524 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.2 mm-40 -81.05 147.84 29.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.714 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -70.72 -15.4 62.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.08 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.31 -16.72 58.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.962 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.12 -47.3 3.55 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.963 -0.637 . . . . 10.0 112.352 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.821 0 N-CA-C 110.612 -0.995 . . . . 10.0 110.612 179.993 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 . . . . . 0 N--CA 1.477 0.9 0 CA-C-O 121.244 0.545 . . . . 10.0 109.912 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . 0.437 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 53.4 t-20 -121.7 123.86 42.87 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.192 -1.04 . . . . 10.0 108.192 179.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -123.12 122.72 39.15 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.414 -0.914 . . . . 10.0 112.811 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . 0.417 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 18.5 t70 -128.82 128.39 23.46 Favored Pre-proline 0 C--N 1.319 -0.755 0 N-CA-C 107.398 -1.334 . . . . 10.0 107.398 174.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 54.0 Cg_endo -111.72 128.44 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.141 0 C-N-CA 121.551 1.501 . . . . 10.0 113.789 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.1 mt -117.48 135.61 57.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.06 -0.973 . . . . 10.0 109.311 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 19.6 t -113.99 133.51 59.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.569 0.699 . . . . 10.0 110.626 -178.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 4.7 tp . . . . . 0 C--N 1.319 -0.727 0 CA-C-N 114.985 -1.007 . . . . 10.0 111.014 -178.35 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 . . . . . 0 N--CA 1.479 1.019 0 N-CA-C 110.246 -0.279 . . . . 10.0 110.246 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.1 mm -118.52 117.41 54.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.535 ' HZ2' ' CD ' ' A' ' 84' ' ' GLU . 0.0 OUTLIER -97.93 108.75 21.52 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.92 0.391 . . . . 10.0 110.855 -179.816 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 66.7 mt -94.26 126.85 39.76 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.966 -0.561 . . . . 10.0 109.909 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 34' ' ' ILE . 33.4 mtpt -96.84 109.7 22.34 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.01 0.433 . . . . 10.0 110.721 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.4 t -91.98 123.71 44.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.63 -0.713 . . . . 10.0 109.665 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.6 mm -94.06 113.22 28.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 120.984 0.421 . . . . 10.0 110.852 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.6 156.3 33.14 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.81 -0.632 . . . . 10.0 112.087 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -70.15 -12.4 61.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.875 0.369 . . . . 10.0 111.362 -179.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -100.69 22.43 11.94 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.35 0.595 . . . . 10.0 110.052 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.2 m 63.71 45.33 4.58 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 114.814 -1.085 . . . . 10.0 111.822 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.2 p -111.58 138.34 48.24 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.206 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.495 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 16.6 mt-10 -108.81 103.94 13.11 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.152 0.501 . . . . 10.0 109.942 179.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.475 ' O ' ' HA ' ' A' ' 25' ' ' LYS . 3.9 mm -91.18 129.91 41.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.443 -179.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.456 ' CD2' ' HB3' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -109.36 101.28 10.28 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.437 -0.347 . . . . 10.0 110.067 -179.696 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.23 115.35 27.3 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.2 -0.296 . . . . 10.0 110.2 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -88.06 100.13 12.7 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.469 HG12 HD11 ' A' ' 47' ' ' LEU . 3.0 m -107.45 174.04 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.996 0.427 . . . . 10.0 111.544 -178.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.3 tttt -123.23 146.7 47.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.817 -0.629 . . . . 10.0 109.493 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.496 ' O ' ' HB ' ' A' ' 41' ' ' THR . 49.0 tpp -77.64 76.02 4.18 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.089 0.471 . . . . 10.0 111.569 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.496 ' HB ' ' O ' ' A' ' 40' ' ' MET . 15.3 t 170.12 -25.83 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.466 -0.788 . . . . 10.0 110.0 178.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.49 134.01 42.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.239 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 31.5 m170 -70.11 143.78 52.27 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.575 -179.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 75.2 mt -69.38 -8.59 47.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 10.0 111.042 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.511 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 37.4 tptt -58.18 -53.99 52.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.527 178.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -61.16 -41.74 97.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.525 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.469 HD11 HG12 ' A' ' 38' ' ' VAL . 3.4 mm? -57.97 -41.79 83.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.609 -179.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -68.67 -31.98 71.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.403 -0.362 . . . . 10.0 111.315 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.511 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 39.7 mt-10 -75.32 -51.78 12.39 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.751 0.31 . . . . 10.0 111.306 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.0 m -61.33 -33.77 74.16 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.278 0.473 . . . . 10.0 112.278 -179.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -63.14 -46.06 89.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.706 0.288 . . . . 10.0 110.778 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.504 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 58.8 m -61.95 -37.23 83.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.093 0.473 . . . . 10.0 110.245 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -61.71 -42.84 99.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.764 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 52.9 ttt85 -69.22 -33.41 73.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.375 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -74.78 -16.42 60.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.708 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.88 30.92 45.66 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.911 -0.661 . . . . 10.0 112.84 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.8 m -137.49 154.53 75.27 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 110.205 -0.295 . . . . 10.0 110.205 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.51 154.64 58.02 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.443 2.095 . . . . 10.0 111.829 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.504 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 3.9 ttt -66.54 157.22 32.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.725 -0.216 . . . . 10.0 110.98 -179.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.446 ' N ' ' HG2' ' A' ' 59' ' ' MET . 4.3 t30 78.02 4.17 2.84 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.633 0.773 . . . . 10.0 111.571 179.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.4 p -87.88 -19.98 26.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.076 0.465 . . . . 10.0 109.958 179.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.0 mt -125.77 135.22 51.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.665 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.509 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 29.1 ptt-85 -112.09 138.96 48.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.241 -0.436 . . . . 10.0 109.88 179.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -96.19 132.03 42.04 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.9 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.0 mt -115.78 115.69 26.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.005 0.431 . . . . 10.0 111.132 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -128.07 118.57 23.71 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.563 -0.744 . . . . 10.0 109.357 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 61.66 29.97 18.35 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.079 0.466 . . . . 10.0 110.752 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.89 -4.28 75.84 Favored Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.862 -0.608 . . . . 10.0 112.604 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 44.8 mm-40 -102.34 136.79 41.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.576 0.226 . . . . 10.0 110.717 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -82.3 128.71 34.47 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.621 -0.511 . . . . 10.0 109.621 178.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 46.6 mm -70.03 118.84 15.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.229 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -90.11 168.78 11.7 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.295 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.91 -24.83 62.54 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.202 0.525 . . . . 10.0 110.579 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -95.77 24.97 4.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.423 -0.808 . . . . 10.0 111.58 -179.045 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 50.1 m170 -109.32 157.47 18.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.79 0.328 . . . . 10.0 110.837 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.586 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 27.9 p -134.26 160.31 68.97 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.067 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -68.73 -14.22 38.7 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.364 2.042 . . . . 10.0 112.012 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -69.65 -34.11 73.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.882 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.586 ' HG2' ' O ' ' A' ' 76' ' ' THR . 6.3 pt-20 -91.22 168.8 11.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.063 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 17.8 mt 73.01 -48.81 0.69 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.405 0.682 . . . . 10.0 111.432 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.14 58.89 0.33 Allowed Glycine 0 N--CA 1.444 -0.77 0 C-N-CA 120.652 -0.785 . . . . 10.0 112.558 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 43.6 mtt -86.34 120.21 27.44 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 179.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -113.17 178.14 4.38 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.204 0.525 . . . . 10.0 111.534 -178.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.535 ' CD ' ' HZ2' ' A' ' 23' ' ' LYS . 3.6 tp10 -69.01 140.52 54.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.413 -0.812 . . . . 10.0 110.762 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 63.6 mm-40 60.59 32.84 20.46 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.792 -0.64 . . . . 10.0 111.582 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -80.61 146.44 31.2 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.663 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 20.2 t -98.11 132.1 43.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.763 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.437 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 20.3 tt -135.42 149.34 28.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.018 179.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -108.95 152.49 24.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.982 0.42 . . . . 10.0 111.382 -179.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.8 p -135.22 135.86 51.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.469 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -137.37 157.22 47.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.716 -0.22 . . . . 10.0 110.791 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -80.61 131.36 35.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.581 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.509 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.6 mm-40 -69.47 145.28 52.86 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.879 -179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -63.21 -23.13 67.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.07 -0.514 . . . . 10.0 111.441 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.0 p -76.74 -20.39 56.57 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.908 0.385 . . . . 10.0 111.219 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.67 -11.18 62.42 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.005 -0.617 . . . . 10.0 111.948 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.786 -1.008 . . . . 10.0 111.275 -179.808 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 55.9 t30 . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.775 0.322 . . . . 10.0 110.77 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . 0.495 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 59.7 t30 -120.24 124.38 45.53 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 109.364 -0.606 . . . . 10.0 109.364 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 24.5 ptt180 -124.2 128.24 48.92 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.42 0.629 . . . . 10.0 111.321 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -120.66 130.33 24.9 Favored Pre-proline 0 C--N 1.318 -0.791 0 N-CA-C 107.569 -1.271 . . . . 10.0 107.569 177.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -108.79 130.59 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.232 0 C-N-CA 121.948 1.765 . . . . 10.0 113.456 -178.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 2.6 mt -117.67 136.44 54.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 113.967 -1.47 . . . . 10.0 109.705 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 60.3 t -113.42 133.01 60.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 N-CA-C 109.109 -0.7 . . . . 10.0 109.109 -179.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 6.3 tp . . . . . 0 C--N 1.319 -0.752 0 CA-C-N 114.628 -1.169 . . . . 10.0 110.948 -176.963 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 . . . . . 0 N--CA 1.477 0.881 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 11.6 mm -112.79 123.28 68.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.432 -0.581 . . . . 10.0 109.432 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.7 ttpm? -100.18 113.7 26.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.953 0.406 . . . . 10.0 111.207 -179.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 80.3 mt -101.26 140.07 36.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.803 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.0 mtpt -101.77 110.44 22.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.758 0.313 . . . . 10.0 110.766 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.46 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 7.1 t -88.1 123.48 40.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 108.915 -0.772 . . . . 10.0 108.915 178.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.8 mm -92.82 111.95 25.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 120.956 0.408 . . . . 10.0 111.473 -178.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.26 156.8 29.85 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 111.314 -0.715 . . . . 10.0 111.314 178.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 48.2 tp60 -64.88 -22.18 66.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.886 0.374 . . . . 10.0 110.992 -179.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -93.98 17.52 12.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.962 0.41 . . . . 10.0 110.819 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.2 m 62.98 45.8 5.16 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.721 -0.672 . . . . 10.0 111.415 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.3 128.74 38.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.959 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.456 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 3.6 mp0 -92.34 88.06 6.28 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.513 0.673 . . . . 10.0 110.255 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.46 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 12.7 mm -80.97 128.63 38.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.617 -0.72 . . . . 10.0 111.929 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.4 ' O ' ' HA ' ' B' ' 361' ' ' PRO . 10.1 m170 -103.7 89.82 3.46 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.143 -0.688 . . . . 10.0 109.143 178.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -92.61 109.54 20.96 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.774 -0.371 . . . . 10.0 110.86 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -88.48 97.28 10.99 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.4 m -98.34 168.15 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.885 -179.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 54.1 tttt -118.43 135.33 54.42 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.261 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 45.3 tpp -80.26 77.46 7.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.088 0.471 . . . . 10.0 110.885 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.8 t 177.95 -37.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.222 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.7 148.79 28.8 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.142 179.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 13.5 m80 -68.9 153.46 43.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.597 0.237 . . . . 10.0 110.743 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.436 HD12 ' HB3' ' A' ' 75' ' ' HIS . 34.7 mt -69.31 -15.86 63.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.506 -0.315 . . . . 10.0 111.136 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 36.2 tttp -59.25 -46.67 87.88 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.928 -0.397 . . . . 10.0 109.928 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.53 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.5 tppp? -58.7 -32.04 68.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.559 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -74.62 -39.33 62.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.626 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -62.86 -52.5 62.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.899 -0.592 . . . . 10.0 111.789 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.404 ' HG2' ' H ' ' A' ' 49' ' ' GLU . 3.1 pt-20 -64.4 -31.74 73.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.582 -0.281 . . . . 10.0 111.461 -179.03 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 53.9 m -72.92 -34.95 66.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.754 0.311 . . . . 10.0 110.918 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -65.98 -36.06 82.29 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.933 0.397 . . . . 10.0 110.14 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 56.6 m -61.95 -40.27 94.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.947 -0.569 . . . . 10.0 109.782 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -66.45 -31.94 73.0 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.54 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.418 HH21 ' CG ' ' B' ' 360' ' ' ASP . 16.9 tpt180 -68.48 -39.74 81.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.871 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -85.51 -16.71 38.65 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.476 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.63 37.93 13.02 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.817 -0.706 . . . . 10.0 112.398 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 9.1 m -133.61 155.41 80.57 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 110.224 -0.288 . . . . 10.0 110.224 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -70.03 167.69 24.07 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.251 1.967 . . . . 10.0 111.373 179.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.7 ttt -74.19 163.52 27.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.608 0.242 . . . . 10.0 110.572 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.2 t30 74.74 0.58 3.6 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.367 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.3 p -86.56 -46.87 9.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.124 0.488 . . . . 10.0 110.036 179.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.2 mt -99.55 131.02 45.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.866 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.528 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 13.2 ptt180 -110.3 128.71 55.67 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.79 179.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -88.5 130.27 35.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.937 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.7 mt -113.81 126.22 54.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.067 0.46 . . . . 10.0 110.397 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -135.62 117.32 15.01 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.624 -0.716 . . . . 10.0 109.926 -179.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 62.74 18.51 10.71 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.761 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.91 -18.73 49.0 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.604 -0.808 . . . . 10.0 112.911 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -98.31 157.77 15.98 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.621 -0.34 . . . . 10.0 110.639 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -96.2 131.26 42.85 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.339 -0.391 . . . . 10.0 110.308 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 48.8 mm -66.68 121.03 15.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.609 -0.723 . . . . 10.0 111.556 -179.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.95 168.26 13.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.57 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -75.67 -18.5 59.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.217 0.532 . . . . 10.0 110.479 179.759 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -96.29 11.44 34.59 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.946 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.436 ' HB3' HD12 ' A' ' 44' ' ' LEU . 2.5 m170 -90.01 145.7 24.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.235 0.541 . . . . 10.0 111.558 -179.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 34.9 p -118.07 155.24 51.52 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.539 -0.755 . . . . 10.0 109.172 178.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_exo -68.96 -7.55 21.09 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.518 2.146 . . . . 10.0 112.805 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -86.51 -33.5 20.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.42 -0.354 . . . . 10.0 111.235 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 11.2 pt-20 -85.48 174.91 9.15 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.619 -0.432 . . . . 10.0 110.006 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.42 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 87.6 mt 73.04 -59.46 0.57 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.318 0.647 . . . . 10.0 110.701 -179.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 132.07 61.63 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.592 -0.813 . . . . 10.0 113.033 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 49.5 mtt -98.42 133.59 42.59 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.354 -0.239 . . . . 10.0 110.354 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.2 mm-40 -132.62 -176.96 4.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.183 0.516 . . . . 10.0 111.436 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -70.06 140.1 52.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.154 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 63.95 27.62 14.38 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 123.526 0.516 . . . . 10.0 111.231 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -74.07 171.12 14.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.04 0.448 . . . . 10.0 111.397 -179.432 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.5 t -121.12 132.73 69.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.898 -178.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 20.5 tt -138.89 140.88 37.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 110.165 -0.309 . . . . 10.0 110.165 179.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -103.35 156.17 17.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.699 -179.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.4 p -143.27 127.27 14.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.112 0.482 . . . . 10.0 110.219 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -136.66 165.23 26.38 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.971 -0.558 . . . . 10.0 110.039 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -90.38 136.81 32.82 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 110.353 -0.239 . . . . 10.0 110.353 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.528 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.1 mm-40 -67.66 164.94 18.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.709 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -68.64 -26.94 65.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.082 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 34.1 p -74.7 -30.86 61.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.36 0.6 . . . . 10.0 110.769 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.98 20.4 67.89 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.208 -0.757 . . . . 10.0 111.208 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.671 -1.072 . . . . 10.0 111.302 -179.596 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 64.2 t30 . . . . . 0 N--CA 1.482 1.153 0 CA-C-O 121.364 0.602 . . . . 10.0 110.492 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 42.5 t30 -119.15 123.09 43.53 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.265 -1.013 . . . . 10.0 108.265 179.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . 0.456 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 13.5 ptt180 -124.14 125.4 44.41 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 120.156 -0.617 . . . . 10.0 111.053 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . 0.418 ' CG ' HH21 ' A' ' 54' ' ' ARG . 30.9 t0 -124.13 130.18 24.47 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 107.544 -1.28 . . . . 10.0 107.544 176.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . 0.4 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 53.0 Cg_endo -108.18 129.51 0.05 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.516 0 C-N-CA 121.969 1.779 . . . . 10.0 111.848 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 10.6 mt -117.35 136.75 53.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 114.695 -1.139 . . . . 10.0 110.276 -178.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 11.4 t -112.17 135.69 50.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.984 -178.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . 0.53 HD11 ' HG3' ' A' ' 46' ' ' LYS . 8.7 tp . . . . . 0 C--N 1.317 -0.807 0 CA-C-N 114.878 -1.055 . . . . 10.0 111.439 -176.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 . . . . . 0 N--CA 1.477 0.905 0 N-CA-C 110.162 -0.31 . . . . 10.0 110.162 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.4 mm -109.68 119.17 58.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 109.408 -0.59 . . . . 10.0 109.408 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.437 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 6.8 ttpm? -96.28 108.65 21.17 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.19 0.519 . . . . 10.0 110.835 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.8 mt -98.3 136.58 38.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.573 179.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 78.3 mttt -97.56 112.84 24.54 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.138 0.494 . . . . 10.0 110.596 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.404 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.8 t -91.95 135.24 27.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.153 -179.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 32.6 mm -90.72 108.39 19.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.619 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.425 ' HA3' ' OG ' ' A' ' 32' ' ' SER . . . -80.71 150.33 31.03 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.809 -0.71 . . . . 10.0 112.043 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -64.08 -22.67 67.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.846 0.355 . . . . 10.0 111.516 -179.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -96.49 26.73 4.21 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.717 0.294 . . . . 10.0 110.92 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 29.5 m 60.63 45.06 10.76 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.502 0.667 . . . . 10.0 110.864 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.425 ' OG ' ' HA3' ' A' ' 28' ' ' GLY . 3.8 p -106.65 149.48 27.19 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.395 -0.821 . . . . 10.0 110.608 -179.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.509 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 28.1 tt0 -108.73 97.34 7.0 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.228 -0.656 . . . . 10.0 109.228 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.404 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 0.8 OUTLIER -86.23 126.24 40.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.658 -178.928 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.8 m170 -101.99 96.79 7.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.114 0.483 . . . . 10.0 109.946 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -89.32 109.98 20.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.923 -0.581 . . . . 10.0 110.425 -179.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -89.72 91.56 8.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.321 179.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.415 ' HA ' ' CG2' ' B' ' 364' ' ' ILE . 5.1 m -100.93 -174.54 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.761 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -135.11 143.85 46.83 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.955 -0.387 . . . . 10.0 109.955 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 60.8 tpp -78.42 60.83 2.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.408 0.623 . . . . 10.0 110.555 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.2 m -161.69 -38.76 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.605 -0.725 . . . . 10.0 109.597 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.59 153.61 38.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.482 -0.781 . . . . 10.0 111.628 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -80.07 151.48 29.86 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.387 -0.824 . . . . 10.0 110.019 179.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.494 ' HA ' HD23 ' A' ' 47' ' ' LEU . 74.7 mt -72.07 -10.63 60.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.743 0.306 . . . . 10.0 110.758 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -59.91 -46.68 88.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.981 178.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.485 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.9 tppp? -62.99 -41.0 99.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.411 -0.813 . . . . 10.0 110.778 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.494 HD23 ' HA ' ' A' ' 44' ' ' LEU . 1.5 mm? -65.07 -41.58 94.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.915 -178.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -58.79 -47.56 84.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.285 -0.416 . . . . 10.0 112.015 -179.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -74.39 -38.22 63.18 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.717 -0.393 . . . . 10.0 111.674 -179.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 63.5 m -59.56 -34.01 72.14 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.888 0.375 . . . . 10.0 110.744 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -69.78 -41.66 74.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.332 -0.395 . . . . 10.0 109.937 178.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.563 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 79.4 m -62.1 -43.38 98.95 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.327 -0.397 . . . . 10.0 109.939 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -63.37 -36.38 83.53 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.215 0.531 . . . . 10.0 110.175 179.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -65.32 -40.33 93.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.404 179.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -77.68 -22.73 50.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.07 -0.513 . . . . 10.0 110.949 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.43 24.96 29.56 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.326 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.5 m -124.07 154.43 68.13 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 110.394 -0.225 . . . . 10.0 110.394 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -61.18 153.05 67.65 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.473 2.116 . . . . 10.0 111.608 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.563 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 17.2 ttt -65.82 152.38 44.51 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 121.232 -0.187 . . . . 10.0 110.889 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.5 t30 82.53 -3.78 1.38 Allowed 'General case' 0 N--CA 1.472 0.644 0 O-C-N 124.175 0.922 . . . . 10.0 111.681 179.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.4 p -79.0 -24.35 43.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.202 0.525 . . . . 10.0 110.326 179.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.1 mt -117.82 131.48 56.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.124 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.432 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 16.6 ptt-85 -104.1 138.27 40.84 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.322 179.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.415 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 73.4 m-85 -100.41 127.26 46.78 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.139 -0.482 . . . . 10.0 109.924 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt -112.17 117.09 31.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.048 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -117.52 107.19 13.98 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.291 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 59.1 34.29 23.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.092 0.472 . . . . 10.0 111.02 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.61 -3.11 87.31 Favored Glycine 0 CA--C 1.518 0.262 0 CA-C-N 115.849 -0.614 . . . . 10.0 113.103 179.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -106.7 128.51 54.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.871 0.336 . . . . 10.0 110.494 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.415 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 13.9 ptm180 -76.25 126.66 31.39 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.074 0.464 . . . . 10.0 110.532 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.4 mm -66.78 123.6 20.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.577 -0.738 . . . . 10.0 110.953 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -84.74 170.9 12.79 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.674 -0.693 . . . . 10.0 110.787 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.48 5.54 17.46 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.96 -0.564 . . . . 10.0 111.147 -179.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -130.32 18.16 5.41 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.708 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.483 ' HB3' HD12 ' A' ' 44' ' ' LEU . 22.3 m170 -88.94 159.46 17.64 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.07 0.462 . . . . 10.0 111.114 -179.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.488 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -131.34 153.47 81.65 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.595 -0.729 . . . . 10.0 110.075 179.678 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.2 -17.82 55.08 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.393 2.062 . . . . 10.0 112.325 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -70.68 -36.67 73.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.925 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 76' ' ' THR . 11.2 pt-20 -85.87 167.23 15.34 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.432 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 84.9 mt 73.79 -51.36 0.69 Allowed 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.208 0.603 . . . . 10.0 110.63 -179.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 117.02 61.41 0.31 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.006 -0.616 . . . . 10.0 113.022 178.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 44.4 mtt -87.32 125.05 33.99 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.759 0.314 . . . . 10.0 110.311 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.508 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 7.4 mm-40 -123.74 177.6 5.63 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.135 0.493 . . . . 10.0 111.336 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.437 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 21.7 tp10 -70.25 142.09 52.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.706 179.407 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.436 ' HG2' ' HG3' ' A' ' 84' ' ' GLU . 70.2 mm-40 68.23 25.06 7.31 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 123.464 0.477 . . . . 10.0 111.039 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.508 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.1 t70 -76.52 162.16 28.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.523 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 95.4 t -117.17 125.52 73.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.869 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.4 tt -129.4 137.55 56.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.061 -0.518 . . . . 10.0 109.959 179.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -103.49 149.56 24.73 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.898 0.38 . . . . 10.0 111.536 -178.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -132.06 130.89 61.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.835 -0.621 . . . . 10.0 109.808 179.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -134.77 157.62 46.28 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.761 0.315 . . . . 10.0 111.138 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -75.4 129.73 37.82 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.679 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.432 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 3.1 mm-40 -79.15 152.65 30.6 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.742 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -77.05 0.15 22.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.707 -0.679 . . . . 10.0 111.433 -178.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.4 p -88.31 -27.86 21.42 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.086 0.469 . . . . 10.0 110.525 179.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.09 16.3 80.66 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.674 -179.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.945 -0.919 . . . . 10.0 110.965 -179.589 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 29.6 t30 . . . . . 0 N--CA 1.483 1.177 0 CA-C-O 120.458 0.171 . . . . 10.0 110.886 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -120.19 119.83 34.37 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 119.703 -0.799 . . . . 10.0 109.451 178.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . 0.509 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 18.4 ptt180 -130.01 129.76 44.12 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.377 0.51 . . . . 10.0 112.377 179.06 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . 0.41 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 23.8 t70 -121.85 129.96 24.94 Favored Pre-proline 0 C--N 1.316 -0.867 0 N-CA-C 107.31 -1.367 . . . . 10.0 107.31 175.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 71.7 Cg_endo -108.37 129.11 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.107 0 C-N-CA 121.651 1.567 . . . . 10.0 112.581 -179.072 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 7.4 mt -117.84 136.36 55.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 114.182 -1.372 . . . . 10.0 110.735 -177.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 99.3 t -114.28 135.2 54.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 108.509 -0.923 . . . . 10.0 108.509 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . 0.485 HD11 ' HG3' ' A' ' 46' ' ' LYS . 8.3 tp . . . . . 0 C--N 1.315 -0.913 0 CA-C-N 114.818 -1.083 . . . . 10.0 112.261 -176.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 N--CA 1.481 1.08 0 CA-C-O 120.84 0.353 . . . . 10.0 110.624 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.8 mm -122.44 117.05 50.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 179.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.56 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.9 ttpm? -93.15 119.49 32.41 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.132 0.491 . . . . 10.0 111.021 -179.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 59.2 mt -102.27 142.38 33.59 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.762 -0.654 . . . . 10.0 110.096 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.3 mtpt -100.12 100.91 11.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.958 0.409 . . . . 10.0 110.481 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.598 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.3 t -86.17 118.01 31.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.8 mm -97.18 112.65 29.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.025 0.441 . . . . 10.0 111.511 -178.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.26 160.09 37.89 Favored Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 110.901 -0.88 . . . . 10.0 110.901 178.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -66.74 -19.35 65.73 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.911 0.355 . . . . 10.0 111.354 -179.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.39 27.65 3.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.52 -0.309 . . . . 10.0 111.047 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.0 m 62.28 33.79 16.35 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.51 179.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.58 110.14 22.27 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.459 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.4 ' OE1' ' N ' ' B' ' 357' ' ' ASN . 8.7 mt-10 -91.79 98.94 11.92 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.252 -0.647 . . . . 10.0 109.252 178.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.408 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 5.1 mm -87.04 127.82 40.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.467 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.446 ' ND1' ' HE3' ' A' ' 23' ' ' LYS . 14.7 m-70 -103.46 85.66 2.51 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -89.92 119.12 30.02 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.566 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -90.91 101.41 14.17 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.136 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 m -97.57 172.1 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.777 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -123.51 141.31 52.13 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.819 -0.437 . . . . 10.0 109.819 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.499 ' SD ' ' HB2' ' A' ' 77' ' ' PRO . 41.4 tpp -78.26 54.23 1.35 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.078 0.466 . . . . 10.0 111.548 -179.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 52.7 m -154.64 -45.15 0.09 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.221 179.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.32 153.05 40.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.693 179.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -79.25 155.82 28.38 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.005 -0.739 . . . . 10.0 109.005 179.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 78.3 mt -69.81 -8.22 46.42 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.78 0.324 . . . . 10.0 111.172 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 47.8 tptt -58.98 -49.47 77.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.989 -0.551 . . . . 10.0 109.98 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.48 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.9 tppp? -59.64 -41.55 90.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.34 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.46 -40.22 95.28 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.418 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -63.95 -45.31 89.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.321 -0.4 . . . . 10.0 112.053 -179.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -73.7 -39.29 64.46 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.668 -0.413 . . . . 10.0 111.536 -179.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.476 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 67.6 m -64.92 -32.47 74.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.825 0.345 . . . . 10.0 111.09 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -65.62 -38.46 89.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.057 0.456 . . . . 10.0 110.391 179.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.507 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 60.2 m -63.01 -36.07 82.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.714 -0.676 . . . . 10.0 110.138 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.476 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 74.2 mt-30 -67.91 -34.18 76.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.802 -0.635 . . . . 10.0 110.515 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -67.43 -38.44 84.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.578 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -80.89 -34.48 33.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.309 -179.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 99.97 37.13 3.98 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.69 -0.767 . . . . 10.0 112.168 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.448 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 2.5 m -137.1 155.82 75.89 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 109.984 -0.376 . . . . 10.0 109.984 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -69.17 155.19 68.65 Favored 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.18 1.92 . . . . 10.0 111.382 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.507 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 11.9 ttt -64.09 158.02 23.87 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 121.097 -0.241 . . . . 10.0 111.176 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.6 t30 81.03 -0.48 1.76 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.75 0.82 . . . . 10.0 111.461 179.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 57.1 p -86.25 -29.5 23.06 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.17 0.509 . . . . 10.0 110.441 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 25.0 mt -119.06 140.47 50.01 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.795 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.479 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 21.4 ptt-85 -117.44 141.59 48.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.159 179.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.467 ' HB3' HD11 ' A' ' 88' ' ' ILE . 93.4 m-85 -96.83 129.72 44.22 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.138 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt -107.58 116.07 31.29 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.963 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -124.68 113.31 17.82 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 61.56 32.55 18.64 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 123.484 0.49 . . . . 10.0 110.964 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.67 -13.79 57.61 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.018 -0.61 . . . . 10.0 113.104 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -100.27 147.35 25.85 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.913 0.387 . . . . 10.0 110.651 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -89.33 126.69 35.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.004 0.43 . . . . 10.0 110.523 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 42.9 mm -63.77 125.26 20.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.568 -0.742 . . . . 10.0 111.191 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.64 -179.25 7.27 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.946 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 1.5 m-20 -88.92 -2.6 58.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.49 -0.323 . . . . 10.0 111.338 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -119.37 12.07 12.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.683 0.278 . . . . 10.0 111.142 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -84.16 153.89 23.42 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.112 0.482 . . . . 10.0 111.722 -179.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.447 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 35.6 p -124.73 157.48 65.77 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.55 -0.75 . . . . 10.0 109.636 178.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . 0.499 ' HB2' ' SD ' ' A' ' 40' ' ' MET . 14.9 Cg_exo -69.23 -12.54 34.15 Favored 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 122.382 2.055 . . . . 10.0 112.692 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -77.07 -41.24 43.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.641 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.6 pt-20 -77.94 160.17 28.39 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 179.243 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 33.9 mt 73.69 -43.65 0.55 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.506 0.504 . . . . 10.0 110.379 -178.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 105.18 74.72 0.96 Allowed Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.965 -0.636 . . . . 10.0 113.55 178.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 36.6 mtt -96.74 131.74 43.15 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.688 -0.486 . . . . 10.0 109.688 178.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.547 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.3 mm-40 -129.9 179.01 6.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.939 0.4 . . . . 10.0 111.47 -179.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.56 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 20.7 tp10 -69.0 142.41 54.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.587 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 66.39 19.89 10.96 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 123.687 0.617 . . . . 10.0 111.249 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.547 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.8 OUTLIER -69.78 138.73 52.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.29 -0.413 . . . . 10.0 110.144 179.96 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.7 t -93.82 120.03 42.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.859 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.598 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 18.3 tt -133.28 139.48 49.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 179.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -112.15 154.28 25.73 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.901 0.382 . . . . 10.0 111.114 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.7 p -128.53 136.21 60.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.802 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -135.59 157.14 47.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.583 0.23 . . . . 10.0 110.823 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -74.41 136.61 42.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.553 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.479 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 6.1 mm-40 -71.39 161.54 30.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.905 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -65.37 -34.04 77.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.827 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.3 p -69.96 -30.2 67.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.002 0.43 . . . . 10.0 110.704 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.27 3.42 87.14 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 121.048 -0.596 . . . . 10.0 111.933 -179.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.961 0 CA-C-O 118.745 -1.031 . . . . 10.0 111.13 -179.889 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . 0.4 ' N ' ' OE1' ' A' ' 33' ' ' GLU . 4.8 p-10 . . . . . 0 N--CA 1.483 1.192 0 N-CA-C 111.395 0.146 . . . . 10.0 111.395 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -119.88 123.76 44.39 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 109.033 -0.729 . . . . 10.0 109.033 179.049 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -125.49 126.47 44.94 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.963 0.727 . . . . 10.0 112.963 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . 0.45 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 39.2 t70 -126.67 127.42 24.49 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 175.538 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 61.4 Cg_endo -110.92 126.03 0.03 OUTLIER 'Trans proline' 0 CA--C 1.536 0.593 0 C-N-CA 121.926 1.75 . . . . 10.0 113.414 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 3.4 mt -122.97 136.73 58.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 114.908 -1.042 . . . . 10.0 110.409 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 43.4 t -113.54 135.66 52.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.014 0.435 . . . . 10.0 110.006 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . 0.48 HD11 ' HG3' ' A' ' 46' ' ' LYS . 7.1 tp . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 115.242 -0.89 . . . . 10.0 111.428 -176.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 109.709 -0.478 . . . . 10.0 109.709 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.502 ' O ' HG22 ' A' ' 38' ' ' VAL . 34.1 mm -73.35 112.25 9.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.954 0.407 . . . . 10.0 110.553 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.507 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -97.18 101.11 12.61 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.102 0.477 . . . . 10.0 110.114 179.601 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 69.9 mt -82.89 157.54 23.04 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.738 -0.664 . . . . 10.0 110.37 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 34' ' ' ILE . 77.8 tttt -120.94 109.03 14.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.938 0.399 . . . . 10.0 110.675 179.437 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.482 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 3.2 t -92.23 128.05 44.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 179.108 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.1 mm -107.22 122.44 61.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.897 0.379 . . . . 10.0 111.068 -179.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -100.78 167.85 20.08 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.756 179.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -65.74 -16.14 63.5 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.231 0.538 . . . . 10.0 110.994 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.2 p-10 -92.24 18.41 8.28 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.254 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.2 m 58.08 42.78 21.88 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.413 0.625 . . . . 10.0 110.96 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -90.75 149.32 22.06 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.322 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.518 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 42.5 mt-10 -116.91 86.95 2.6 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.249 -0.649 . . . . 10.0 109.249 178.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.482 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 44.2 mm -79.04 118.69 26.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.151 -179.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 20.6 m170 -102.16 89.29 3.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.947 -0.76 . . . . 10.0 108.947 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -92.03 116.0 28.55 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.854 -178.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -90.44 97.88 11.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.035 -0.529 . . . . 10.0 109.587 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.502 HG22 ' O ' ' A' ' 22' ' ' ILE . 2.8 m -100.77 170.42 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.61 -179.488 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.1 tttt -122.33 141.07 51.93 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.404 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 62.3 tpp -79.37 75.14 5.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.559 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -176.92 -41.8 0.01 OUTLIER 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.383 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.93 147.49 36.93 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.764 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.7 m80 -75.61 153.37 37.33 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 53.6 mt -69.93 -4.97 22.96 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.752 0.31 . . . . 10.0 111.324 -179.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 46.2 tptt -61.36 -48.79 79.66 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.536 ' HG3' HD11 ' B' ' 364' ' ' ILE . 4.2 tppp? -62.91 -35.23 79.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.276 -0.874 . . . . 10.0 110.256 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.77 -46.97 70.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.683 -0.69 . . . . 10.0 111.031 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -60.57 -44.16 96.49 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.998 -0.546 . . . . 10.0 112.11 -179.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -70.81 -41.93 70.92 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.97 -0.292 . . . . 10.0 111.655 -178.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.9 m -64.47 -32.47 74.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.705 0.288 . . . . 10.0 111.222 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -68.77 -35.02 76.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.848 0.356 . . . . 10.0 110.24 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.492 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 85.6 m -62.37 -40.02 95.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.181 0.515 . . . . 10.0 109.927 179.211 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -67.36 -30.73 70.61 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.364 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -68.27 -30.0 68.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.221 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -98.48 -4.95 33.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.319 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.63 36.88 62.03 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.878 -0.677 . . . . 10.0 112.54 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 13.4 m -130.5 152.53 80.49 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 110.067 -0.346 . . . . 10.0 110.067 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -69.82 158.16 57.81 Favored 'Trans proline' 0 N--CA 1.466 -0.13 0 C-N-CA 122.256 1.971 . . . . 10.0 111.443 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.492 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 12.0 ttt -66.74 157.65 32.25 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.959 -0.296 . . . . 10.0 110.348 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.9 t30 79.06 -5.88 1.95 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.483 0.713 . . . . 10.0 111.46 179.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.4 p -81.72 -24.16 36.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.855 0.359 . . . . 10.0 110.832 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 79.2 mt -119.02 143.36 47.12 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.907 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.505 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 16.5 ptt-85 -116.18 128.14 55.38 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.172 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -90.8 128.31 36.66 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.05 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.7 mt -111.01 131.22 55.23 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.62 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -143.03 117.41 9.64 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.56 -0.745 . . . . 10.0 109.97 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 61.07 29.66 19.05 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.782 -0.645 . . . . 10.0 111.883 179.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.41 -4.77 85.89 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.71 -0.757 . . . . 10.0 112.784 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -112.78 156.2 23.27 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.187 -0.301 . . . . 10.0 110.187 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -95.66 134.96 37.96 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.072 0.463 . . . . 10.0 110.679 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 37.3 mm -71.79 115.88 12.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.478 -0.783 . . . . 10.0 110.321 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.41 167.05 21.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.169 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.59 11.17 2.18 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.765 -178.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -133.56 11.96 4.09 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.107 0.479 . . . . 10.0 110.325 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -81.93 151.7 27.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.521 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 31.9 p -125.02 153.46 71.27 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.003 179.18 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -66.96 -12.51 36.39 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 122.461 2.107 . . . . 10.0 112.454 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -75.8 -35.82 59.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.706 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 76' ' ' THR . 9.9 pt-20 -91.25 170.26 10.15 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.827 -0.434 . . . . 10.0 109.827 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mt 72.63 -49.79 0.7 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.261 0.625 . . . . 10.0 110.999 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.82 76.26 0.59 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 121.022 -0.608 . . . . 10.0 112.496 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 34.9 mtt -106.52 123.77 48.59 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.997 -0.372 . . . . 10.0 109.997 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.547 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 5.1 mm-40 -122.17 178.87 4.74 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.307 0.575 . . . . 10.0 112.013 -179.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.507 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 28.3 tp10 -67.7 137.58 55.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.462 -0.79 . . . . 10.0 109.945 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 65.3 27.79 11.99 Favored 'General case' 0 N--CA 1.464 0.249 0 O-C-N 123.61 0.569 . . . . 10.0 111.112 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.547 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.6 t0 -77.0 142.08 40.08 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.305 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 29.6 t -91.45 120.88 41.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.055 -0.521 . . . . 10.0 111.37 -179.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 15.3 tt -129.49 142.78 43.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 108.954 -0.758 . . . . 10.0 108.954 178.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -119.14 153.61 34.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.029 0.442 . . . . 10.0 111.449 -178.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.9 p -135.73 133.84 51.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.851 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -134.04 164.3 27.64 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.617 -0.265 . . . . 10.0 110.677 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -72.87 134.31 44.78 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.481 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.505 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 0.7 OUTLIER -72.08 164.48 26.08 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.231 179.931 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -68.06 -36.45 79.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.502 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.0 p -71.18 -30.26 66.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.11 0.481 . . . . 10.0 111.008 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.73 5.4 89.88 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.579 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.829 -0.984 . . . . 10.0 111.012 -179.802 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 22.0 m120 . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.512 0.196 . . . . 10.0 111.228 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . 0.518 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 54.5 t30 -119.6 119.62 34.31 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 177.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . 0.5 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 14.1 ptt85 -126.59 129.58 48.82 Favored 'General case' 0 CA--C 1.506 -0.722 0 C-N-CA 119.857 -0.737 . . . . 10.0 112.094 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . 0.435 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 31.7 t70 -121.8 132.48 24.23 Favored Pre-proline 0 C--N 1.311 -1.09 0 N-CA-C 107.298 -1.371 . . . . 10.0 107.298 177.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 58.5 Cg_endo -106.81 129.69 0.05 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.438 0 C-N-CA 121.914 1.742 . . . . 10.0 112.328 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 9.5 mt -118.97 136.92 54.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 113.884 -1.507 . . . . 10.0 110.774 -178.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 52.6 t -113.39 135.07 54.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.295 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . 0.536 HD11 ' HG3' ' A' ' 46' ' ' LYS . 9.3 tp . . . . . 0 C--N 1.32 -0.697 0 CA-C-N 114.951 -1.022 . . . . 10.0 110.546 -176.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 110.178 -0.304 . . . . 10.0 110.178 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.7 mm -112.82 117.51 55.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.778 -0.453 . . . . 10.0 109.778 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.7 OUTLIER -97.06 102.95 14.84 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.138 0.494 . . . . 10.0 110.796 -179.463 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 45.3 mt -82.79 146.96 28.67 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.872 -0.604 . . . . 10.0 109.808 179.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.7 ttpt -110.95 99.54 8.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.011 0.434 . . . . 10.0 109.986 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.456 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.9 t -78.16 133.05 31.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.929 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.434 ' HB ' ' HG2' ' A' ' 89' ' ' GLU . 15.4 mm -92.1 110.29 22.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.902 -179.345 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.441 ' HA3' ' OG ' ' A' ' 32' ' ' SER . . . -83.0 160.49 38.8 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.625 -0.798 . . . . 10.0 112.053 179.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -64.02 -31.97 73.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.791 0.329 . . . . 10.0 111.334 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -92.03 25.85 2.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.055 0.455 . . . . 10.0 110.468 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.1 m 63.4 32.95 14.17 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.502 -0.772 . . . . 10.0 111.003 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.441 ' OG ' ' HA3' ' A' ' 28' ' ' GLY . 0.3 OUTLIER -84.9 129.94 34.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.526 -0.761 . . . . 10.0 109.989 179.397 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -97.99 94.83 7.08 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.591 -0.522 . . . . 10.0 109.591 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.456 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 4.6 mm -77.9 121.75 31.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.209 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.6 m170 -101.97 89.24 3.57 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.276 -0.42 . . . . 10.0 109.88 -179.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.413 ' CD2' HD12 ' B' ' 362' ' ' ILE . 0.1 OUTLIER -96.29 118.48 32.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.296 -179.663 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -91.57 102.02 14.67 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.387 -0.369 . . . . 10.0 110.174 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.2 m -100.4 170.94 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.587 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -123.16 135.44 54.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.063 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.412 ' O ' ' HB ' ' A' ' 41' ' ' THR . 60.8 tpp -75.49 74.39 2.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.038 -179.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.412 ' HB ' ' O ' ' A' ' 40' ' ' MET . 15.0 t 178.25 -30.96 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.481 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.68 153.27 22.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.895 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -75.78 150.47 37.75 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.114 179.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 34.8 mt -70.0 -9.96 56.99 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.327 -0.397 . . . . 10.0 111.494 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.9 tptt -59.78 -47.18 86.74 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 178.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.47 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.6 tppp? -60.49 -29.74 69.26 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.65 -0.705 . . . . 10.0 110.59 179.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 47' ' ' LEU . 3.8 mm? -79.66 -41.07 27.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.229 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -65.56 -35.36 80.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.268 -0.424 . . . . 10.0 111.111 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.418 ' OE2' ' HG3' ' A' ' 59' ' ' MET . 2.6 mm-40 -71.38 -43.85 66.09 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.103 -179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.3 p -66.57 -37.8 85.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.685 -178.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -59.86 -45.13 93.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.698 0.285 . . . . 10.0 110.454 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.448 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.3 m -60.45 -42.63 96.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.049 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -63.68 -38.45 91.15 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.45 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 -65.38 -36.74 84.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.398 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -76.04 -20.59 57.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.969 -0.559 . . . . 10.0 110.375 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 86.53 26.99 31.13 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.787 -0.642 . . . . 10.0 112.525 179.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.2 m -131.93 158.82 74.44 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 110.453 -0.203 . . . . 10.0 110.453 -179.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.23 166.01 18.08 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.452 2.101 . . . . 10.0 112.02 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.448 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 0.2 OUTLIER -72.2 159.39 34.19 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.907 -179.621 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 t30 69.31 13.81 8.52 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.328 0.651 . . . . 10.0 111.49 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 38.9 p -89.2 -22.69 22.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.255 0.55 . . . . 10.0 109.776 178.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 mt -127.7 142.24 51.38 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.482 -0.781 . . . . 10.0 110.591 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.7 ptt-85 -112.05 130.65 55.8 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.013 -0.539 . . . . 10.0 110.024 179.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.491 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 98.0 m-85 -90.65 131.99 36.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.439 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 93.7 mt -113.97 120.11 39.53 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.14 0.495 . . . . 10.0 111.03 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -127.24 112.73 15.44 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.554 -0.906 . . . . 10.0 108.554 179.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 65.65 25.6 11.56 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.089 0.471 . . . . 10.0 110.265 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.92 -14.77 62.45 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.753 -0.658 . . . . 10.0 112.749 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -98.85 148.07 24.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.776 0.322 . . . . 10.0 110.809 -179.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.491 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 14.2 ptm180 -85.3 132.19 34.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.964 0.411 . . . . 10.0 110.519 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 41.8 mm -71.24 127.1 32.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.224 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.3 -173.7 3.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.647 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -93.22 -33.36 14.01 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.035 0.445 . . . . 10.0 110.698 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -90.3 4.91 49.34 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.779 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -73.57 147.11 44.21 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.637 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.561 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -124.97 151.22 68.51 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.876 179.479 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -62.65 -15.86 49.06 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.527 2.151 . . . . 10.0 112.413 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -64.92 -41.92 95.14 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.285 179.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 76' ' ' THR . 7.7 pt-20 -89.11 171.67 9.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.806 -0.634 . . . . 10.0 109.599 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 18.3 mt 73.23 -49.49 0.69 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.689 0.618 . . . . 10.0 111.139 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.39 76.57 0.83 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 121.101 -0.571 . . . . 10.0 112.27 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 43.9 mtt -106.43 125.67 51.29 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.718 0.294 . . . . 10.0 110.38 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.502 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.2 mm-40 -124.75 178.61 5.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.04 0.448 . . . . 10.0 111.235 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.477 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 19.2 tp10 -67.86 138.67 56.25 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.476 179.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 64.51 26.34 13.37 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 123.614 0.571 . . . . 10.0 111.429 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.502 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -71.17 155.6 40.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.421 179.919 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 57.3 t -99.15 120.82 49.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.135 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 11.4 tt -136.45 136.59 48.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.225 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.434 ' HG2' ' HB ' ' A' ' 27' ' ' ILE . 60.7 mt-10 -113.07 159.25 19.38 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.795 0.331 . . . . 10.0 111.081 -179.298 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.3 p -142.16 131.19 22.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.425 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -131.16 158.69 39.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.402 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -71.24 138.0 49.09 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.82 0.343 . . . . 10.0 110.937 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -75.08 160.78 30.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.857 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -64.9 -42.65 94.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.991 -0.549 . . . . 10.0 110.313 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.97 -40.71 96.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.571 -0.74 . . . . 10.0 111.5 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 99.8 -16.23 58.78 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.825 -0.702 . . . . 10.0 112.458 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.001 0 CA-C-O 119.174 -0.792 . . . . 10.0 111.551 -179.946 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 65.4 t30 . . . . . 0 N--CA 1.487 1.413 0 CA-C-O 121.028 0.442 . . . . 10.0 110.79 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -120.88 121.35 37.9 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.291 -1.003 . . . . 10.0 108.291 178.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 23.9 ptt180 -127.51 130.14 48.65 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 112.454 0.538 . . . . 10.0 112.454 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . 0.45 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 31.0 t70 -120.12 128.79 25.66 Favored Pre-proline 0 C--N 1.317 -0.842 0 N-CA-C 105.632 -1.988 . . . . 10.0 105.632 175.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 48.8 Cg_endo -108.64 127.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.237 0 C-N-CA 121.542 1.494 . . . . 10.0 113.688 -177.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . 0.413 HD12 ' CD2' ' A' ' 36' ' ' PHE . 1.7 mt -121.19 134.54 64.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 114.147 -1.388 . . . . 10.0 110.182 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 77.8 t -114.68 136.43 51.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.18 -0.674 . . . . 10.0 109.18 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . 0.47 HD11 ' HG3' ' A' ' 46' ' ' LYS . 7.9 tp . . . . . 0 C--N 1.315 -0.91 0 CA-C-N 114.766 -1.107 . . . . 10.0 111.316 -176.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 . . . . . 0 N--CA 1.479 1.021 0 CA-C-O 120.692 0.282 . . . . 10.0 110.271 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.0 mm -122.78 108.4 21.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.504 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.7 OUTLIER -94.82 106.17 18.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.218 0.532 . . . . 10.0 110.677 -179.667 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 30.5 mt -90.76 146.92 23.58 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.231 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.9 mtpt -109.44 105.51 14.89 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.932 -0.395 . . . . 10.0 109.932 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.501 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.5 t -86.7 131.4 34.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.739 179.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.5 mm -84.83 104.41 12.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.278 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -72.25 152.13 47.87 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.82 -0.705 . . . . 10.0 112.172 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -61.2 -28.97 69.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.823 0.345 . . . . 10.0 110.981 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -96.14 23.94 6.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.754 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 m 64.77 34.41 9.5 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.089 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.2 p -92.47 142.5 27.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.475 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.436 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 24.4 mt-10 -98.12 102.34 14.06 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.947 -0.39 . . . . 10.0 109.947 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.501 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 9.1 mm -87.49 117.04 30.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.332 -0.395 . . . . 10.0 110.331 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -97.03 92.62 6.16 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.856 -0.424 . . . . 10.0 109.856 179.553 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.34 108.03 20.48 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.993 -0.373 . . . . 10.0 109.993 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -88.28 102.26 14.66 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.795 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -101.84 167.51 2.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.119 -0.492 . . . . 10.0 111.091 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 67.6 tttt -115.82 133.06 56.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.004 -0.544 . . . . 10.0 109.559 179.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.508 ' O ' ' HB ' ' A' ' 41' ' ' THR . 59.5 tpp -75.47 80.33 2.51 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.363 -0.38 . . . . 10.0 111.127 -179.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.508 ' HB ' ' O ' ' A' ' 40' ' ' MET . 14.7 t 172.04 -27.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.371 179.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.7 150.69 26.59 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.861 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.3 m80 -71.09 144.89 50.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.363 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.434 ' HA ' HD23 ' A' ' 47' ' ' LEU . 19.0 mt -67.71 -12.8 61.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.966 0.412 . . . . 10.0 110.293 179.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.8 tptt -57.91 -47.93 81.39 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.794 178.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.46 ' HG3' HD11 ' B' ' 364' ' ' ILE . 4.9 tppp? -62.57 -33.56 75.2 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.178 -0.919 . . . . 10.0 110.708 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' A' ' 44' ' ' LEU . 3.3 mm? -71.33 -37.48 71.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.873 -179.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -68.87 -46.6 68.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.773 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.433 ' OE1' ' HA ' ' A' ' 46' ' ' LYS . 14.8 pt-20 -66.68 -43.41 84.55 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.586 0.217 . . . . 10.0 111.586 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.439 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 19.3 m -64.15 -33.47 75.85 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.809 0.3 . . . . 10.0 111.809 -179.164 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -65.06 -42.7 93.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.791 0.329 . . . . 10.0 110.298 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.428 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 39.6 m -61.81 -39.46 91.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.183 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.439 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.4 mt-30 -63.68 -36.92 85.42 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.359 179.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -67.38 -37.51 83.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.546 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -79.67 -13.74 59.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.943 -0.571 . . . . 10.0 111.003 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.59 27.92 56.18 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.254 -0.498 . . . . 10.0 112.687 179.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.5 m -129.25 151.27 77.49 Favored Pre-proline 0 C--N 1.328 -0.365 0 O-C-N 122.663 -0.316 . . . . 10.0 110.698 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.84 151.73 75.18 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.504 2.136 . . . . 10.0 111.678 179.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.428 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 19.4 ttt -63.81 159.24 19.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.495 -0.321 . . . . 10.0 111.058 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.6 t30 78.18 4.07 2.77 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.662 0.785 . . . . 10.0 111.751 179.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.3 p -92.43 -20.21 21.25 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.874 0.369 . . . . 10.0 111.017 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.1 mt -116.75 136.54 52.88 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.279 -0.418 . . . . 10.0 111.245 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.442 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 28.0 ptt-85 -105.91 131.49 53.15 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.909 179.152 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -99.13 119.56 38.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.833 -0.621 . . . . 10.0 109.777 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.7 mt -108.73 114.89 29.06 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.239 0.542 . . . . 10.0 111.385 -178.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -123.18 118.8 28.47 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.368 -0.975 . . . . 10.0 108.368 178.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 64.66 20.16 12.05 Favored 'General case' 0 N--CA 1.464 0.231 0 O-C-N 123.544 0.527 . . . . 10.0 110.342 -178.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.93 -13.12 68.1 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 115.755 -0.657 . . . . 10.0 112.719 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -98.17 150.84 21.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.822 0.344 . . . . 10.0 111.016 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 70' ' ' ARG . 11.7 ptm180 -88.97 124.73 34.53 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.432 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.1 mm -66.04 126.73 25.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.614 -0.721 . . . . 10.0 111.022 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -84.15 -179.88 7.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.621 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.21 -5.94 57.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.901 0.381 . . . . 10.0 111.099 -179.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -113.38 14.7 19.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.995 0.426 . . . . 10.0 110.666 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 20.1 m170 -87.16 158.31 19.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.397 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.548 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 10.6 p -134.13 154.71 80.26 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.435 -0.802 . . . . 10.0 109.399 178.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.02 -9.59 25.57 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.352 2.035 . . . . 10.0 112.121 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -71.6 -34.19 69.66 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.6 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.548 ' HG2' ' O ' ' A' ' 76' ' ' THR . 5.5 pt-20 -92.78 171.99 8.63 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.006 -0.368 . . . . 10.0 110.006 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.7 mt 73.13 -44.45 0.59 Allowed 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.829 0.706 . . . . 10.0 111.051 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 107.87 60.53 0.56 Allowed Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 121.228 -0.511 . . . . 10.0 111.96 179.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 47.9 mtt -87.63 126.62 35.06 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.031 -0.359 . . . . 10.0 110.031 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.466 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 18.0 mm-40 -130.51 178.59 6.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.335 0.588 . . . . 10.0 112.136 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.504 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 20.3 tp10 -67.85 137.69 55.5 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.323 -0.853 . . . . 10.0 110.333 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 5.9 mm-40 69.46 26.64 5.13 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.615 0.572 . . . . 10.0 111.607 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.466 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.3 OUTLIER -80.98 146.87 30.49 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.956 -0.387 . . . . 10.0 109.956 179.343 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 98.5 t -100.64 127.67 53.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.206 -0.452 . . . . 10.0 111.0 -179.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.4 tt -132.2 146.63 32.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.654 -0.498 . . . . 10.0 109.654 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -110.34 152.22 26.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.848 0.356 . . . . 10.0 111.48 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 10.6 p -141.12 130.0 24.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.932 179.088 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -135.62 164.29 28.17 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.493 -0.322 . . . . 10.0 110.385 -179.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -83.4 132.07 35.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.771 0.319 . . . . 10.0 110.584 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.442 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.8 mm-40 -72.72 156.12 39.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.013 -0.54 . . . . 10.0 111.55 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -70.22 -22.0 62.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.492 -0.776 . . . . 10.0 111.273 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.9 p -77.34 -19.5 56.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.933 0.397 . . . . 10.0 111.241 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 74.19 10.71 81.73 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.741 -0.742 . . . . 10.0 111.642 -179.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.93 0 CA-C-O 118.65 -1.083 . . . . 10.0 111.202 -179.709 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 64.7 t30 . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 121.046 0.45 . . . . 10.0 110.76 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 358' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 52.8 t30 -119.15 121.42 39.71 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 108.189 -1.041 . . . . 10.0 108.189 178.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 359' ' ' ARG . . . . . 0.417 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 24.9 ptt180 -128.73 130.22 46.81 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.642 0.608 . . . . 10.0 112.642 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 360' ' ' ASP . . . . . 0.469 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 32.9 t70 -119.87 131.49 24.39 Favored Pre-proline 0 C--N 1.318 -0.769 0 N-CA-C 107.018 -1.475 . . . . 10.0 107.018 175.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 361' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 68.5 Cg_endo -109.63 128.95 0.04 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 121.775 1.65 . . . . 10.0 113.911 -178.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 3.0 mt -118.1 135.72 57.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 114.316 -1.311 . . . . 10.0 110.1 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 59.0 t -114.68 136.61 50.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 108.889 -0.782 . . . . 10.0 108.889 -179.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 364' ' ' ILE . . . . . 0.46 HD11 ' HG3' ' A' ' 46' ' ' LYS . 6.4 tp . . . . . 0 C--N 1.316 -0.882 0 CA-C-N 115.354 -0.839 . . . . 10.0 112.149 -175.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 . . . . . 0 N--CA 1.479 1.0 0 CA-C-O 120.714 0.292 . . . . 10.0 110.517 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 32.4 mm -105.81 126.62 61.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.124 -0.489 . . . . 10.0 109.774 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.427 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.4 ttpm? -99.56 97.74 8.69 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.088 0.471 . . . . 10.0 110.546 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 69.5 mt -84.77 144.84 28.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.334 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.5 mtpt -102.53 107.78 18.86 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.932 0.396 . . . . 10.0 110.696 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.43 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 3.0 t -91.05 122.07 42.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 109.078 -0.712 . . . . 10.0 109.078 178.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 39.1 mm -91.15 108.59 20.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 120.933 0.397 . . . . 10.0 111.158 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.97 158.03 49.28 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.767 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -63.71 -22.09 66.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.63 0.252 . . . . 10.0 111.556 -178.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -103.41 28.63 6.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.794 0.33 . . . . 10.0 111.42 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.7 m 65.69 27.53 11.29 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.693 -0.685 . . . . 10.0 112.243 178.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.29 125.8 35.25 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.558 -0.534 . . . . 10.0 109.558 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -97.5 102.54 14.33 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.19 0.519 . . . . 10.0 110.627 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.43 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 2.9 mm -89.67 129.83 39.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.522 -179.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.2 m170 -103.7 94.82 5.65 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -91.09 116.02 28.48 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.371 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.3 mtmt -86.56 99.65 11.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.179 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.458 HG12 HD11 ' A' ' 47' ' ' LEU . 3.4 m -104.06 171.48 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.936 -179.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 49.5 tttm -127.41 140.02 52.44 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.493 ' SD ' ' HB2' ' A' ' 77' ' ' PRO . 43.9 tpp -75.55 63.68 1.55 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.226 0.536 . . . . 10.0 110.609 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.9 m -161.42 -40.14 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.676 -0.693 . . . . 10.0 109.663 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.2 163.36 27.14 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.32 -0.854 . . . . 10.0 111.983 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -90.47 153.62 20.25 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.182 -0.917 . . . . 10.0 109.768 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.5 mt -72.72 -10.6 59.99 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.163 -0.215 . . . . 10.0 111.146 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 30.8 tptt -60.36 -47.31 86.63 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.281 -0.637 . . . . 10.0 109.281 177.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -62.92 -37.2 86.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.144 -0.935 . . . . 10.0 110.486 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.458 HD11 HG12 ' A' ' 38' ' ' VAL . 3.3 mm? -69.14 -45.31 70.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.319 -179.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -60.01 -47.15 87.02 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.222 -0.445 . . . . 10.0 112.063 -179.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -69.27 -37.69 78.02 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 121.051 -0.259 . . . . 10.0 111.584 -178.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.452 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 45.8 m -66.09 -35.65 81.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.852 0.358 . . . . 10.0 111.391 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -66.65 -35.49 80.29 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.495 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 64.5 m -63.86 -35.24 79.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.953 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.452 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 64.2 mt-30 -71.02 -33.71 70.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.178 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.64 -32.99 74.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.599 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -92.15 -29.29 16.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.264 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 97.1 33.08 6.14 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 120.741 -0.742 . . . . 10.0 112.442 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.8 m -128.39 156.96 76.09 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 110.262 -0.273 . . . . 10.0 110.262 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -68.87 156.54 65.08 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.125 1.884 . . . . 10.0 111.197 179.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.495 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 12.1 ttt -67.02 156.43 36.05 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.962 -0.295 . . . . 10.0 110.38 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.4 t30 79.78 -0.27 2.14 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 123.932 0.77 . . . . 10.0 111.697 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 76.0 p -85.89 -27.84 24.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.141 0.496 . . . . 10.0 110.089 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 63.1 mt -112.31 129.83 56.16 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.744 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.474 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.6 ptt-85 -100.86 129.97 46.81 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.798 179.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -96.82 117.86 32.0 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.5 mt -103.66 124.55 49.04 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.336 0.588 . . . . 10.0 111.128 -178.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -127.51 105.38 8.46 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.186 -0.915 . . . . 10.0 109.227 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 65.54 25.13 11.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.459 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.98 -11.37 65.98 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.927 -0.654 . . . . 10.0 112.958 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -101.4 148.62 24.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.782 0.291 . . . . 10.0 110.285 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 70' ' ' ARG . 9.6 ptm180 -89.3 131.43 35.4 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.99 0.424 . . . . 10.0 110.376 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 45.7 mm -69.89 120.91 18.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.217 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -85.19 169.19 14.08 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.326 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.409 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 38.7 m-20 -72.62 -30.75 64.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.905 0.383 . . . . 10.0 111.237 -179.353 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 18.1 p-10 -91.23 9.38 31.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.877 0.37 . . . . 10.0 111.146 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.407 ' HB2' ' O ' ' A' ' 72' ' ' ALA . 1.4 m170 -74.94 148.97 39.56 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.107 0.48 . . . . 10.0 110.765 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.606 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -133.59 145.42 56.22 Favored Pre-proline 0 C--N 1.32 -0.689 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.082 179.33 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.493 ' HB2' ' SD ' ' A' ' 40' ' ' MET . 31.6 Cg_exo -59.04 -13.27 18.3 Favored 'Trans proline' 0 N--CA 1.477 0.522 0 C-N-CA 122.834 2.356 . . . . 10.0 112.991 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -73.7 -27.57 61.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.558 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.606 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.0 pt-20 -98.65 172.45 7.47 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.694 -0.484 . . . . 10.0 109.694 179.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 31.5 mt 72.26 -55.9 0.66 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.685 0.616 . . . . 10.0 110.989 -179.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 121.27 66.42 0.25 Allowed Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 121.076 -0.583 . . . . 10.0 112.377 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 60.6 mtt -96.78 137.4 35.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.555 0.217 . . . . 10.0 110.497 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.475 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 2.4 mm-40 -138.04 -173.04 3.4 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.042 0.449 . . . . 10.0 111.307 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.427 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 24.6 tp10 -73.67 140.58 46.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.001 -0.545 . . . . 10.0 109.909 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 68.25 23.59 7.75 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 123.604 0.565 . . . . 10.0 110.682 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.5 t0 -72.18 152.53 42.2 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.071 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 41.3 t -107.19 122.66 61.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.439 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.9 tt -126.27 134.34 66.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.306 -0.627 . . . . 10.0 109.306 178.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -103.34 145.92 29.24 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.771 0.32 . . . . 10.0 111.312 -178.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -126.99 125.31 66.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.115 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -130.19 157.31 42.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.608 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -82.97 131.74 35.17 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.101 -0.333 . . . . 10.0 110.101 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.474 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.2 mm-40 -78.92 154.54 29.59 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.66 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -70.51 -14.83 62.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.96 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.5 p -74.43 -25.42 59.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.759 179.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.84 -9.59 44.02 Favored Glycine 0 C--N 1.332 0.328 0 CA-C-N 115.919 -0.582 . . . . 10.0 112.107 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.799 -1.001 . . . . 10.0 110.928 -179.339 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 7.0 t30 . . . . . 0 N--CA 1.483 1.203 0 CA-C-O 121.07 0.462 . . . . 10.0 110.62 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 57.2 t-20 -118.08 124.71 48.74 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 109.052 -0.722 . . . . 10.0 109.052 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -122.98 128.26 49.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.225 0.536 . . . . 10.0 111.554 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . 0.436 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 18.5 t0 -122.19 130.2 24.8 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 108.376 -0.972 . . . . 10.0 108.376 178.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 59.9 Cg_endo -109.13 127.56 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.115 0 C-N-CA 121.275 1.317 . . . . 10.0 113.904 -179.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 2.0 mt -119.96 136.89 55.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 113.815 -1.539 . . . . 10.0 109.192 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 3.1 t -113.95 135.79 52.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-O 121.659 0.742 . . . . 10.0 109.861 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 3.6 tp -113.09 145.0 19.6 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 114.248 -1.342 . . . . 10.0 111.326 -176.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -110.12 129.12 55.75 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.898 -1.046 . . . . 10.0 111.263 -174.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo . . . . . 0 C--O 1.251 1.14 0 C-N-CA 123.133 2.555 . . . . 10.0 111.976 179.316 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 . . . . . 0 N--CA 1.483 1.219 0 CA-C-O 120.468 0.175 . . . . 10.0 110.588 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 38.1 mm -114.1 116.0 51.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.436 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.2 ttpm? -99.95 106.53 18.34 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.986 0.422 . . . . 10.0 110.451 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 31.2 mt -90.99 150.92 21.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.648 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.5 mtpt -107.16 109.68 21.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.283 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.451 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.4 t -92.6 126.59 45.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 179.223 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 27.3 mm -94.8 112.22 26.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.978 0.418 . . . . 10.0 110.992 -179.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.25 160.66 35.03 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.776 -0.647 . . . . 10.0 112.028 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.9 tp60 -63.08 -32.82 74.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.044 0.387 . . . . 10.0 112.044 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -88.9 25.66 1.74 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.777 0.322 . . . . 10.0 111.52 -179.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.6 m 65.66 42.58 3.56 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.251 0.548 . . . . 10.0 111.13 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.6 p -101.82 135.11 43.92 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.276 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -108.49 96.39 6.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.272 0.558 . . . . 10.0 109.495 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.451 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 7.2 mm -79.99 129.67 37.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.682 -0.69 . . . . 10.0 111.261 -178.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -101.32 86.23 2.95 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.624 -0.717 . . . . 10.0 109.654 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.27 117.77 30.47 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.506 -0.478 . . . . 10.0 110.167 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -93.22 104.11 16.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.401 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.4 m -103.54 170.49 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.341 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -123.12 135.72 54.49 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.272 -0.27 . . . . 10.0 110.272 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.55 ' O ' ' HB ' ' A' ' 41' ' ' THR . 62.3 tpp -74.13 76.24 1.76 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.437 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.55 ' HB ' ' O ' ' A' ' 40' ' ' MET . 12.0 t 170.39 -24.86 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.334 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.79 151.95 24.0 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.188 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -74.03 144.27 45.17 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.762 -0.653 . . . . 10.0 110.099 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 58.7 mt -75.0 -4.19 36.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.003 0.43 . . . . 10.0 110.616 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.3 tptt -58.17 -50.86 72.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.627 -0.715 . . . . 10.0 109.549 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.425 ' HG3' HD11 ' B' ' 364' ' ' ILE . 4.0 tppp? -63.21 -39.14 93.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.765 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -62.29 -43.37 98.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.072 -0.513 . . . . 10.0 111.582 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -62.62 -45.39 93.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.29 -0.414 . . . . 10.0 112.082 -179.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -73.52 -35.78 65.63 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.0 -0.28 . . . . 10.0 111.715 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.0 m -64.72 -30.81 71.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.952 0.406 . . . . 10.0 110.807 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -69.14 -36.23 77.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.102 0.477 . . . . 10.0 109.796 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.568 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.3 m -63.5 -37.1 86.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.179 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -63.55 -34.61 78.17 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.399 179.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -69.85 -37.93 76.31 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.573 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -79.88 -18.29 51.04 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.796 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.34 24.62 62.97 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.933 -0.651 . . . . 10.0 112.018 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.417 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 18.3 m -124.93 155.92 69.75 Favored Pre-proline 0 C--N 1.325 -0.46 0 N-CA-C 110.618 -0.142 . . . . 10.0 110.618 -179.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -65.18 154.62 72.62 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.553 2.169 . . . . 10.0 111.993 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.568 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 17.2 ttt -67.5 157.91 33.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.853 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 33.5 t30 79.21 4.16 2.29 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.767 0.827 . . . . 10.0 111.656 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -93.29 -20.61 20.24 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.126 0.489 . . . . 10.0 109.994 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 43.2 mt -116.81 137.81 51.94 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.618 -0.719 . . . . 10.0 110.771 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.49 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 20.1 ptt-85 -107.44 132.04 53.62 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.258 179.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -95.72 115.56 27.6 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.5 mt -105.52 112.5 25.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.065 0.459 . . . . 10.0 110.717 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -117.86 110.63 18.0 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.343 179.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 61.51 28.62 17.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.464 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.18 -21.43 46.05 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.9 -0.667 . . . . 10.0 113.815 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -99.06 150.96 21.47 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 117.269 0.535 . . . . 10.0 111.192 -178.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.2 ptm85 -87.09 134.68 33.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.157 0.503 . . . . 10.0 110.565 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.9 mm -75.25 125.48 34.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.998 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -85.32 168.79 14.36 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.301 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.81 -25.72 59.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.92 0.39 . . . . 10.0 110.872 -179.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -98.08 20.59 12.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.761 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.5 m170 -88.77 156.97 18.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.729 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.484 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 5.0 p -134.78 154.74 79.58 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.83 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -64.85 -15.01 48.21 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.382 2.055 . . . . 10.0 112.119 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -70.1 -40.37 74.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.817 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.4 pt-20 -85.54 167.9 14.99 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.818 -0.438 . . . . 10.0 109.818 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.1 mt 73.06 -53.04 0.71 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.108 0.563 . . . . 10.0 110.754 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.79 81.41 0.86 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.931 -0.652 . . . . 10.0 112.464 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.2 mtt -109.11 132.0 54.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.685 0.279 . . . . 10.0 110.286 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -128.66 -177.11 4.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.555 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.436 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 21.5 tp10 -74.89 137.03 41.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.446 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 68.89 28.19 5.38 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.675 0.609 . . . . 10.0 111.203 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.82 153.94 30.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.005 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 67.2 t -105.53 132.7 51.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.975 0.416 . . . . 10.0 111.744 -178.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.1 tt -136.95 143.36 35.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.088 -0.708 . . . . 10.0 109.088 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -110.69 149.82 29.92 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.951 0.405 . . . . 10.0 111.472 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.6 p -136.91 132.17 47.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.841 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -139.02 165.32 27.45 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.447 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -80.19 135.97 36.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.232 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.49 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.1 mm-40 -78.49 171.07 15.64 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.861 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -89.17 -5.59 57.61 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.108 0.48 . . . . 10.0 109.855 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.0 p -78.07 -67.76 0.7 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.68 -0.691 . . . . 10.0 111.123 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 130.13 -28.79 3.81 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.001 -0.619 . . . . 10.0 111.93 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.69 -1.061 . . . . 10.0 111.538 179.658 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 42.0 t30 . . . . . 0 N--CA 1.483 1.205 0 CA-C-O 120.962 0.41 . . . . 10.0 110.392 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -122.32 121.38 36.6 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.382 -0.97 . . . . 10.0 108.382 177.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -126.25 128.71 47.62 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.9 0.704 . . . . 10.0 112.9 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . 0.41 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 28.6 t70 -124.18 129.71 24.63 Favored Pre-proline 0 C--N 1.313 -0.989 0 N-CA-C 106.73 -1.581 . . . . 10.0 106.73 175.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 43.6 Cg_endo -109.84 127.92 0.04 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 121.843 1.696 . . . . 10.0 113.959 -178.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.9 mt -118.95 135.93 57.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 114.739 -1.119 . . . . 10.0 110.112 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 1.4 t -113.29 135.4 52.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.129 -0.487 . . . . 10.0 109.94 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . 0.425 HD11 ' HG3' ' A' ' 46' ' ' LYS . 6.1 tp -114.06 144.34 21.86 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 114.964 -1.016 . . . . 10.0 110.929 -177.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -110.81 128.96 55.96 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 122.082 0.944 . . . . 10.0 111.378 -175.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo . . . . . 0 C--O 1.246 0.898 0 C-N-CA 122.766 2.311 . . . . 10.0 111.479 179.712 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 110.161 -0.311 . . . . 10.0 110.161 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.5 mm -113.86 125.83 71.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.368 -0.378 . . . . 10.0 109.983 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -96.46 105.16 17.2 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.083 0.468 . . . . 10.0 111.213 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 91.3 mt -90.6 140.85 29.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.905 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.2 mtpt -106.53 116.47 31.98 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.933 0.397 . . . . 10.0 111.135 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.509 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.8 t -101.98 123.84 55.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 108.869 -0.789 . . . . 10.0 108.869 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 37.7 mm -97.78 108.52 21.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.063 0.459 . . . . 10.0 110.832 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.29 170.9 54.31 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.678 -0.692 . . . . 10.0 112.014 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -70.63 -19.17 62.84 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.974 0.416 . . . . 10.0 110.898 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -96.38 21.66 8.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.454 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.3 m 61.97 37.47 14.98 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.476 -0.784 . . . . 10.0 111.136 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 p -90.18 138.93 31.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.126 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 2.0 mt-10 -104.7 94.05 5.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.095 0.474 . . . . 10.0 110.051 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.509 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 19.6 mm -80.84 121.64 34.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.027 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -103.01 88.05 3.07 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.518 -0.549 . . . . 10.0 109.518 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -91.01 114.58 27.14 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.405 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.6 ttmt -86.99 97.99 11.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.046 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.487 HG12 HD11 ' A' ' 47' ' ' LEU . 4.0 m -100.72 172.95 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.621 -179.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 tttt -124.55 135.6 53.29 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.82 -0.437 . . . . 10.0 109.82 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 56.8 tpp -74.61 78.64 1.99 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.891 0.377 . . . . 10.0 111.313 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 7.0 t 174.67 -32.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.336 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.493 ' OG1' ' HB2' ' B' ' 366' ' ' ASP . 0.2 OUTLIER -78.22 148.43 33.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.888 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -72.16 148.96 45.13 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.407 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 80.1 mt -71.22 -6.51 40.19 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.997 0.427 . . . . 10.0 110.463 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.473 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 42.7 tptt -57.38 -52.86 63.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.752 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.43 ' HZ3' ' P ' ' B' ' 365' ' ' SEP . 5.5 tppp? -60.79 -33.82 73.56 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.221 -0.9 . . . . 10.0 111.072 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.487 HD11 HG12 ' A' ' 38' ' ' VAL . 4.0 mm? -69.63 -44.98 69.54 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.223 -179.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 57.1 mtpt -61.13 -47.01 88.21 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.982 -178.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 6.5 pt-20 -68.06 -43.07 79.48 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.932 -0.307 . . . . 10.0 111.603 -179.074 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.1 m -62.7 -34.28 76.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.702 0.287 . . . . 10.0 111.199 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -66.6 -38.85 87.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.697 0.284 . . . . 10.0 110.291 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.578 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.5 m -63.47 -41.28 98.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 10.0 109.828 179.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -64.25 -36.61 84.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.328 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -63.02 -32.08 73.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.847 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -89.63 -31.13 17.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.718 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 106.96 -19.92 34.46 Favored Glycine 0 C--O 1.23 -0.135 0 C-N-CA 121.111 -0.566 . . . . 10.0 112.251 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.414 HG22 ' H ' ' A' ' 57' ' ' VAL . 5.0 m -77.29 155.5 81.93 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 110.543 -0.169 . . . . 10.0 110.543 -179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -62.11 168.03 9.83 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.479 2.12 . . . . 10.0 111.875 179.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.578 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 24.9 ttt -70.46 148.16 48.63 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.785 0.326 . . . . 10.0 111.45 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t30 73.52 6.78 5.09 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.124 -0.944 . . . . 10.0 112.501 178.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.3 p -76.73 -24.85 53.03 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.852 -0.795 . . . . 10.0 108.852 178.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 56.1 mt -115.15 132.24 56.67 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 114.863 -1.062 . . . . 10.0 109.757 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.54 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 13.2 ptt-85 -100.86 129.98 46.8 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.202 -0.453 . . . . 10.0 110.417 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.472 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 64.9 m-85 -91.42 119.1 31.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.018 179.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.8 mt -108.98 121.24 44.7 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.539 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -129.96 111.07 12.18 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.652 -0.703 . . . . 10.0 109.627 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 66.57 23.5 10.36 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.214 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.94 -8.23 70.32 Favored Glycine 0 N--CA 1.453 -0.195 0 C-N-CA 121.014 -0.612 . . . . 10.0 113.1 179.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -109.33 144.14 37.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.587 0.232 . . . . 10.0 110.668 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.472 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 11.9 ptm180 -84.01 133.83 34.66 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.173 0.511 . . . . 10.0 110.438 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.1 mm -71.68 125.02 29.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.878 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.02 167.22 19.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.09 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.39 -25.25 59.37 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.162 0.506 . . . . 10.0 110.719 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -96.13 13.74 26.24 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.791 -0.64 . . . . 10.0 111.073 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.9 m170 -85.35 152.52 23.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.149 0.5 . . . . 10.0 111.223 -179.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.515 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 35.4 p -124.43 155.58 68.58 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.95 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -70.94 -10.78 28.27 Favored 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.166 1.911 . . . . 10.0 112.19 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -77.76 -30.1 51.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.386 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.2 pt-20 -92.81 174.69 7.12 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.583 -0.525 . . . . 10.0 109.583 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 4.8 mt 72.89 -56.59 0.66 Allowed 'General case' 0 N--CA 1.469 0.503 0 O-C-N 123.548 0.53 . . . . 10.0 111.017 -179.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 126.16 66.12 0.17 Allowed Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 121.206 -0.521 . . . . 10.0 111.917 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 55.7 mtt -101.85 134.21 45.39 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.738 0.304 . . . . 10.0 110.367 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 0.3 OUTLIER -138.65 178.61 7.02 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.766 -179.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.429 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 13.4 tp10 -67.02 143.71 56.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.265 -0.425 . . . . 10.0 109.944 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 22.4 mm-40 70.4 22.24 5.36 Favored 'General case' 0 C--O 1.232 0.169 0 O-C-N 123.716 0.635 . . . . 10.0 111.732 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.3 OUTLIER -78.89 153.23 30.68 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.352 179.433 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 89.6 t -115.77 128.45 73.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.441 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.9 tt -124.49 144.61 33.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.434 -0.58 . . . . 10.0 109.434 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -105.38 144.84 31.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.849 0.357 . . . . 10.0 110.893 -178.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 9.8 p -135.81 129.86 48.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.987 0.422 . . . . 10.0 110.226 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -135.54 167.69 20.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.508 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -83.18 134.1 34.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.714 0.293 . . . . 10.0 111.145 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.54 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 3.0 mm-40 -74.14 152.42 39.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.396 179.491 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -70.3 -17.16 63.08 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.774 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.2 p -77.08 -25.12 51.97 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.191 0.519 . . . . 10.0 110.639 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.25 -3.81 86.59 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.933 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.822 -0.988 . . . . 10.0 111.295 -179.732 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 65.9 t30 . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 121.014 0.435 . . . . 10.0 110.595 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 54.1 t30 -121.77 122.24 39.05 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.532 -0.914 . . . . 10.0 108.532 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . 0.481 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 23.2 ptt180 -126.0 128.7 47.87 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 119.791 -0.764 . . . . 10.0 112.035 179.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . 0.406 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 28.2 t70 -120.8 130.87 24.65 Favored Pre-proline 0 C--N 1.316 -0.864 0 N-CA-C 106.8 -1.556 . . . . 10.0 106.8 177.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 58.4 Cg_endo -108.07 128.61 0.05 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.524 0 C-N-CA 121.481 1.454 . . . . 10.0 113.179 -178.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.2 mt -119.27 136.99 54.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 114.128 -1.396 . . . . 10.0 109.734 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 48.7 t -113.25 135.21 53.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.269 0.557 . . . . 10.0 109.59 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 7.1 tp -112.96 144.01 21.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 114.854 -1.067 . . . . 10.0 110.594 -177.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . 0.43 ' P ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . 0.493 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 1.1 t70 -113.28 129.19 56.59 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.396 -1.274 . . . . 10.0 110.568 -176.346 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo . . . . . 0 C--O 1.246 0.891 0 C-N-CA 122.598 2.198 . . . . 10.0 111.396 179.77 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.5 mm -113.02 124.43 69.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 110.002 -0.37 . . . . 10.0 110.002 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.403 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 2.8 ttpm? -102.38 112.98 25.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.032 0.444 . . . . 10.0 110.385 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.1 mt -98.07 135.49 39.68 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.307 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -95.34 113.45 25.12 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.671 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.537 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.5 t -96.41 128.42 47.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.745 -0.662 . . . . 10.0 109.584 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.3 mm -101.54 109.49 25.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 120.838 0.352 . . . . 10.0 110.747 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -76.74 174.09 54.27 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 121.027 -0.606 . . . . 10.0 112.626 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 13.8 tp60 -69.92 -29.91 67.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.81 0.338 . . . . 10.0 111.662 -179.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -104.96 40.6 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.062 0.458 . . . . 10.0 111.17 -179.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.7 m 57.9 36.0 25.87 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.692 -0.686 . . . . 10.0 111.328 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.65 94.42 9.85 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.691 -0.686 . . . . 10.0 109.929 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.644 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 20.6 mt-10 -78.64 104.9 9.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.086 0.47 . . . . 10.0 109.784 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.1 mm -95.57 136.79 25.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.28 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 45.9 m-70 -110.97 95.33 5.48 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.512 -0.551 . . . . 10.0 109.512 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.04 121.28 34.22 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.356 -0.383 . . . . 10.0 110.499 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -89.17 107.4 19.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.809 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.407 HG12 HD11 ' A' ' 47' ' ' LEU . 4.4 m -110.27 171.05 3.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.969 0.414 . . . . 10.0 110.94 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 75.4 tttt -122.33 140.56 52.52 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.538 ' O ' ' HB ' ' A' ' 41' ' ' THR . 51.6 tpp -74.94 74.9 2.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.745 0.307 . . . . 10.0 111.449 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.538 ' HB ' ' O ' ' A' ' 40' ' ' MET . 14.5 t 169.82 -24.91 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.559 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -75.99 149.6 37.58 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.887 0.375 . . . . 10.0 110.934 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 25.4 m170 -78.36 138.31 38.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.003 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.1 mt -65.69 -16.17 63.5 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.528 -0.305 . . . . 10.0 111.46 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.44 ' HD2' ' HB3' ' A' ' 73' ' ' ASP . 34.7 tttp -60.31 -42.9 96.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.012 0.434 . . . . 10.0 109.91 178.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -65.58 -30.72 71.49 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.034 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.407 HD11 HG12 ' A' ' 38' ' ' VAL . 4.4 mm? -74.56 -49.13 23.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.626 -0.715 . . . . 10.0 111.094 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -56.61 -46.8 80.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.567 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -65.21 -40.37 94.05 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.167 -0.47 . . . . 10.0 111.282 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 65.9 m -67.41 -34.66 77.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.311 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -63.37 -40.84 98.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.995 0.426 . . . . 10.0 109.869 179.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 39.0 m -62.73 -42.21 99.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.767 179.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -64.76 -30.41 71.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.646 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -72.52 -45.15 60.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.033 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -76.56 -14.12 60.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.409 -0.36 . . . . 10.0 111.01 -179.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.71 37.17 17.41 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.864 -0.684 . . . . 10.0 112.178 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.6 m -130.42 155.4 81.08 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-O 120.511 0.196 . . . . 10.0 110.547 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -66.22 163.95 29.82 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 122.176 1.917 . . . . 10.0 111.92 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 12.1 tpt -70.62 150.68 45.78 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 110.065 -0.346 . . . . 10.0 110.065 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.0 t30 73.75 5.99 4.9 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.105 0.562 . . . . 10.0 112.166 179.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 80.4 p -84.0 -23.29 31.05 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.145 0.497 . . . . 10.0 110.351 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 43.7 mt -121.21 147.21 45.92 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.428 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.441 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 18.0 ptt-85 -116.9 134.24 55.01 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.243 -0.435 . . . . 10.0 109.963 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.415 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 86.0 m-85 -95.9 128.29 42.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.091 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 90.7 mt -112.23 125.89 54.64 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.229 0.538 . . . . 10.0 111.369 -179.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -137.59 118.51 14.25 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.537 -0.912 . . . . 10.0 108.537 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 66.23 19.6 11.07 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.218 0.532 . . . . 10.0 110.494 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.16 -4.84 84.61 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.221 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -105.39 145.46 30.77 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.189 -0.3 . . . . 10.0 110.189 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.415 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 12.1 ptm180 -85.0 125.76 32.98 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.089 0.471 . . . . 10.0 110.214 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 43.6 mm -63.98 123.58 17.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.313 -0.858 . . . . 10.0 111.52 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.07 166.22 15.19 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.203 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.44 ' HB3' ' HD2' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -73.89 -19.15 60.79 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.995 0.426 . . . . 10.0 111.378 -179.389 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -97.06 17.22 17.53 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.117 -0.492 . . . . 10.0 111.045 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -99.94 153.03 19.5 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.051 0.453 . . . . 10.0 111.129 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.424 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 57.5 p -131.63 162.82 53.9 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 108.961 -0.755 . . . . 10.0 108.961 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -69.99 -5.91 17.47 Favored 'Trans proline' 0 CA--C 1.53 0.317 0 C-N-CA 122.33 2.02 . . . . 10.0 112.16 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.64 -30.38 61.61 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.683 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.49 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 1.4 pt-20 -101.38 171.56 7.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.162 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 7.5 mt 73.26 -49.0 0.69 Allowed 'General case' 0 N--CA 1.469 0.498 0 O-C-N 123.699 0.624 . . . . 10.0 111.285 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 113.53 76.27 0.73 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.83 -0.7 . . . . 10.0 112.443 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 58.1 mtt -105.76 122.46 46.12 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.837 0.351 . . . . 10.0 110.265 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.533 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 5.4 mm-40 -120.97 -178.75 3.82 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.949 -179.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.403 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 15.9 tp10 -70.74 144.03 51.06 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 109.421 -0.585 . . . . 10.0 109.421 179.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 67.04 23.54 9.7 Favored 'General case' 0 N--CA 1.462 0.171 0 O-C-N 123.523 0.514 . . . . 10.0 110.904 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.533 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.8 OUTLIER -75.6 148.51 38.75 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.862 -0.421 . . . . 10.0 109.862 179.788 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 94.8 t -107.13 119.57 56.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.038 0.447 . . . . 10.0 111.446 -178.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.537 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 15.6 tt -118.49 136.36 55.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -103.07 150.65 23.39 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.84 0.352 . . . . 10.0 110.975 -178.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.6 p -136.43 131.43 48.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.012 179.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -135.02 159.87 40.14 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.411 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -73.49 136.92 44.2 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.505 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.441 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 1.3 mm-40 -73.5 159.62 32.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.697 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -72.98 -24.79 60.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.191 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.8 p -78.28 -34.27 49.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.214 0.53 . . . . 10.0 110.899 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.31 12.92 77.84 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.925 -0.87 . . . . 10.0 110.925 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.947 0 CA-C-O 118.876 -0.958 . . . . 10.0 111.283 -179.642 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 . . . . . 0 N--CA 1.48 1.025 0 CA-C-O 121.347 0.594 . . . . 10.0 110.168 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . 0.644 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 2.5 m-20 -120.17 125.88 49.3 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 108.454 -0.943 . . . . 10.0 108.454 179.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 22.3 ptt180 -125.84 122.05 35.02 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 119.378 -0.929 . . . . 10.0 113.019 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -128.46 127.27 23.64 Favored Pre-proline 0 C--N 1.316 -0.888 0 N-CA-C 107.536 -1.283 . . . . 10.0 107.536 174.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -110.78 126.34 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.154 0 C-N-CA 121.66 1.573 . . . . 10.0 113.086 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.7 mt -120.27 135.56 60.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.027 -0.988 . . . . 10.0 109.707 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 21.6 t -113.19 135.74 51.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.47 0.652 . . . . 10.0 109.721 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . 0.426 HD12 ' HA ' ' B' ' 364' ' ' ILE . 7.8 tp -113.27 147.9 16.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 114.836 -1.075 . . . . 10.0 112.107 -176.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -113.7 131.92 55.99 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.301 -0.863 . . . . 10.0 112.367 -174.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_endo . . . . . 0 C--O 1.248 1.011 0 C-N-CA 123.132 2.554 . . . . 10.0 112.293 179.547 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 . . . . . 0 N--CA 1.478 0.95 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.418 ' O ' HG22 ' A' ' 38' ' ' VAL . 39.1 mm -118.55 113.4 41.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.762 -0.459 . . . . 10.0 109.762 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.418 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 2.6 ttpm? -96.7 111.61 23.7 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.236 -0.438 . . . . 10.0 109.9 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 30.1 mt -94.03 150.87 19.95 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.4 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 38.0 mtpt -110.31 107.53 17.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.284 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.488 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 3.2 t -89.08 126.21 42.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.974 -0.557 . . . . 10.0 109.598 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.9 mm -93.54 115.87 33.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 120.984 0.421 . . . . 10.0 111.188 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.59 147.1 19.75 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 111.256 -0.738 . . . . 10.0 111.256 178.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -64.47 -21.14 66.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.778 0.323 . . . . 10.0 111.811 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -95.45 28.21 3.03 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 120.857 0.36 . . . . 10.0 111.021 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.1 m 61.0 66.42 0.9 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.588 0.708 . . . . 10.0 110.919 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.2 p -136.59 144.85 44.34 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.096 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -118.57 103.86 10.12 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.137 -0.69 . . . . 10.0 109.137 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.488 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 5.5 mm -88.77 119.74 36.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.197 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -96.93 96.53 8.58 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -97.3 112.86 24.49 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.398 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -86.73 103.13 14.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.977 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.418 HG22 ' O ' ' A' ' 22' ' ' ILE . 2.9 m -108.31 173.13 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.816 0.341 . . . . 10.0 110.675 -179.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.433 ' HD2' ' CG2' ' A' ' 41' ' ' THR . 23.4 ttmt -121.9 137.79 54.65 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.298 -0.63 . . . . 10.0 109.298 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.45 ' O ' ' HB ' ' A' ' 41' ' ' THR . 61.9 tpp -73.94 78.9 1.65 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.957 0.408 . . . . 10.0 110.598 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.45 ' HB ' ' O ' ' A' ' 40' ' ' MET . 15.3 t 174.09 -26.33 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.444 -0.798 . . . . 10.0 110.081 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.31 151.88 26.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.417 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.415 ' ND1' ' HB3' ' A' ' 45' ' ' LYS . 6.3 p80 -76.87 145.55 38.26 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.097 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.5 mt -71.83 -8.97 57.47 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.588 -0.278 . . . . 10.0 111.285 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.415 ' HB3' ' ND1' ' A' ' 43' ' ' HIS . 47.3 tptt -59.47 -48.2 82.57 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.061 0.458 . . . . 10.0 110.007 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.574 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.4 tppp? -62.85 -33.94 76.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.309 -0.859 . . . . 10.0 110.715 179.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.414 HD11 HG12 ' A' ' 38' ' ' VAL . 3.1 mm? -71.98 -44.24 63.83 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.286 -179.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -61.63 -42.6 99.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.297 -0.41 . . . . 10.0 111.399 -179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -72.34 -39.83 67.84 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 121.001 -0.28 . . . . 10.0 111.289 -179.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.437 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 66.4 m -63.45 -35.77 81.53 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.75 0.31 . . . . 10.0 111.411 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -64.32 -41.46 96.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.799 0.333 . . . . 10.0 110.177 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 57.2 m -62.3 -38.23 88.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.348 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.437 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.4 mt-30 -65.9 -42.9 89.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.79 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -61.75 -35.67 78.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.417 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -83.22 -16.82 45.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.849 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.31 35.58 42.25 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.094 -0.574 . . . . 10.0 112.535 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.3 m -131.37 155.55 81.34 Favored Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 110.24 -0.282 . . . . 10.0 110.24 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.34 159.57 39.18 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.358 2.039 . . . . 10.0 111.769 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 16.0 ttt -71.01 155.95 40.21 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 121.225 -0.19 . . . . 10.0 110.702 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 32.8 t30 76.65 -7.38 1.85 Allowed 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.542 0.737 . . . . 10.0 111.981 179.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.5 p -75.79 -19.45 58.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.226 0.536 . . . . 10.0 110.276 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.3 mt -116.97 135.27 53.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.253 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.433 ' HD3' ' OE2' ' A' ' 93' ' ' GLU . 7.1 ptt180 -111.34 119.96 40.61 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.145 0.498 . . . . 10.0 110.432 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -88.22 124.92 34.33 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.889 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 34.2 mt -114.5 124.86 52.97 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.044 0.449 . . . . 10.0 110.974 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -135.17 119.88 18.3 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.281 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 64.78 20.57 12.17 Favored 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.433 0.458 . . . . 10.0 111.136 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.71 2.45 81.75 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.912 -0.661 . . . . 10.0 112.302 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -114.76 145.06 42.52 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.749 -0.463 . . . . 10.0 109.749 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -80.98 142.19 33.69 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.975 0.417 . . . . 10.0 109.901 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.2 mm -79.28 121.17 31.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.427 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.7 169.47 18.18 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.505 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -81.71 -18.27 44.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.808 0.337 . . . . 10.0 111.085 -179.06 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -101.86 0.96 36.44 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.781 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 18.4 m170 -71.53 159.13 35.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.936 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.6 p -134.57 160.71 67.42 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.826 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -67.12 -14.66 44.15 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.454 2.103 . . . . 10.0 112.249 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -69.28 -46.41 67.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.527 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -82.79 172.91 12.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.147 -0.478 . . . . 10.0 109.839 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.0 mt 73.45 -46.56 0.64 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.164 0.586 . . . . 10.0 111.047 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 110.9 63.48 0.5 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 121.185 -0.531 . . . . 10.0 112.68 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 43.5 mtt -101.68 128.45 47.99 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.844 0.354 . . . . 10.0 110.711 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 2.8 mm-40 -132.56 -174.39 3.44 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.63 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.418 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 42.5 tp10 -66.28 138.33 57.57 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.183 -179.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 66.27 26.3 10.39 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 123.727 0.642 . . . . 10.0 111.9 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.4 OUTLIER -76.3 141.52 41.59 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.851 -0.426 . . . . 10.0 109.851 179.04 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 59.6 t -96.36 120.26 45.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.504 -178.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 15.3 tt -128.8 138.16 55.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.646 -0.707 . . . . 10.0 109.193 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -112.74 149.7 32.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.97 0.414 . . . . 10.0 111.462 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.4 p -130.96 133.86 62.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.184 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -124.84 168.77 12.79 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.985 -0.552 . . . . 10.0 109.577 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -83.08 138.76 33.57 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.362 -0.607 . . . . 10.0 109.362 178.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.433 ' OE2' ' HD3' ' A' ' 63' ' ' ARG . 2.8 mm-40 -74.67 170.41 15.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.197 0.522 . . . . 10.0 111.139 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -82.87 -28.87 29.75 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.483 -0.78 . . . . 10.0 109.687 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -74.35 -55.15 6.33 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.603 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 104.4 11.87 30.26 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.608 -0.806 . . . . 10.0 112.835 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.794 0 CA-C-O 118.891 -0.949 . . . . 10.0 111.913 179.548 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 121.22 0.534 . . . . 10.0 110.869 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 63.0 t-20 -121.16 124.09 43.88 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.458 -0.571 . . . . 10.0 109.458 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 33.2 ptt180 -123.3 126.08 46.24 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.286 0.565 . . . . 10.0 112.507 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -125.33 128.68 24.68 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 108.263 -1.014 . . . . 10.0 108.263 176.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -111.02 128.0 0.03 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 121.851 1.7 . . . . 10.0 113.52 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 6.1 mt -120.51 137.26 54.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 114.807 -1.088 . . . . 10.0 109.965 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 37.7 t -112.54 134.57 54.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.309 -0.626 . . . . 10.0 109.309 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . 0.574 HD11 ' HG3' ' A' ' 46' ' ' LYS . 7.6 tp -113.91 145.42 19.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 114.809 -1.087 . . . . 10.0 111.514 -176.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.95 129.91 56.02 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 114.954 -1.021 . . . . 10.0 111.204 -175.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo . . . . . 0 C--O 1.246 0.883 0 C-N-CA 122.809 2.34 . . . . 10.0 112.404 179.679 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 N--CA 1.475 0.822 0 CA-C-O 120.782 0.325 . . . . 10.0 110.436 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 18.1 mm -106.3 123.18 60.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.499 -0.556 . . . . 10.0 109.499 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.478 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 4.5 ttpm? -96.47 108.12 20.63 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.183 0.516 . . . . 10.0 110.691 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.8 mt -93.36 137.37 32.73 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.844 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -99.87 106.97 18.86 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.116 0.484 . . . . 10.0 110.819 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.0 t -89.41 130.15 39.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.293 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 41.7 mm -91.01 111.59 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.905 0.383 . . . . 10.0 110.779 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -77.37 157.86 46.8 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.689 -0.687 . . . . 10.0 112.235 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 12.6 tp60 -58.52 -32.24 68.65 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.923 0.342 . . . . 10.0 111.923 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -97.07 29.16 3.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.775 0.321 . . . . 10.0 111.387 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 m 64.52 35.4 9.38 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.351 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.23 136.98 32.72 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.725 -0.67 . . . . 10.0 110.101 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -100.16 101.04 11.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.891 0.376 . . . . 10.0 110.344 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -88.61 120.61 37.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.268 -0.423 . . . . 10.0 109.94 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -100.18 98.62 9.3 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -99.98 118.63 36.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.143 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.4 ttmt -91.9 103.49 16.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.241 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 5.0 m -100.2 171.36 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.24 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -121.53 141.73 50.77 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.225 -0.443 . . . . 10.0 109.976 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.411 ' O ' ' HB ' ' A' ' 41' ' ' THR . 57.8 tpp -81.08 73.05 8.13 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.016 0.436 . . . . 10.0 111.032 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.411 ' HB ' ' O ' ' A' ' 40' ' ' MET . 8.9 t 175.95 -26.16 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.192 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.57 147.36 25.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.254 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 29.8 m80 -75.52 148.8 38.67 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.242 -0.281 . . . . 10.0 110.242 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.514 ' HA ' HD23 ' A' ' 47' ' ' LEU . 35.7 mt -67.66 -10.53 53.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.813 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.552 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 51.2 tptt -57.77 -43.85 85.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.766 -0.652 . . . . 10.0 109.738 178.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -67.4 -32.21 72.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.395 -0.821 . . . . 10.0 110.956 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.514 HD23 ' HA ' ' A' ' 44' ' ' LEU . 2.7 mm? -74.05 -42.92 59.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.542 -178.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -59.76 -48.37 81.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.939 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 20.0 pt-20 -67.7 -37.81 82.77 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.864 0.32 . . . . 10.0 111.864 -178.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 42.6 m -68.34 -32.6 72.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.695 0.283 . . . . 10.0 111.463 -179.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 50.1 t80 -66.87 -39.05 87.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.893 0.377 . . . . 10.0 110.224 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.528 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 81.2 m -62.17 -36.72 82.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.41 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -65.14 -35.96 82.76 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.121 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -64.8 -36.16 83.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.69 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -92.24 -6.92 49.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.394 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 69.58 36.81 77.08 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.917 -0.658 . . . . 10.0 112.43 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.512 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 17.6 m -126.0 155.21 73.59 Favored Pre-proline 0 C--N 1.323 -0.583 0 N-CA-C 110.133 -0.321 . . . . 10.0 110.133 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -68.85 157.85 60.2 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.126 1.884 . . . . 10.0 111.588 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.528 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 9.4 ttt -69.72 154.74 41.56 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.036 -0.265 . . . . 10.0 110.344 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.3 t30 77.35 -3.59 2.43 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 123.939 0.775 . . . . 10.0 111.575 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 87.5 p -83.84 -19.0 35.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.204 0.526 . . . . 10.0 109.71 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 82.6 mt -117.02 126.13 52.41 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.268 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.465 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.8 ptt-85 -100.0 121.86 42.02 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.095 0.474 . . . . 10.0 109.858 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -89.99 111.9 23.13 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.8 mt -99.61 113.3 25.64 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.227 -178.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -113.82 101.61 9.45 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.375 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 60.57 38.37 18.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.026 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.07 -34.0 4.79 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.852 -0.613 . . . . 10.0 113.045 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -83.7 135.04 34.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.716 0.294 . . . . 10.0 110.819 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -83.46 131.81 35.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.979 0.419 . . . . 10.0 110.416 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 48.3 mm -68.27 120.64 16.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.824 -0.625 . . . . 10.0 111.583 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.14 177.67 8.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.278 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.552 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 0.8 OUTLIER -83.86 -14.02 52.22 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.552 -0.294 . . . . 10.0 111.504 -179.074 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.4 p-10 -108.89 9.88 26.57 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.679 -0.237 . . . . 10.0 111.391 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.4 ' HB3' HD12 ' A' ' 44' ' ' LEU . 3.1 m170 -78.56 157.36 28.81 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.957 0.408 . . . . 10.0 111.265 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.541 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.8 OUTLIER -136.54 154.0 76.46 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.64 179.521 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -66.42 -11.0 29.71 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.741 2.294 . . . . 10.0 112.745 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -74.62 -24.34 58.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.32 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.541 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.5 pt-20 -107.18 -179.01 3.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.123 -0.49 . . . . 10.0 109.713 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.44 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 6.1 mt 71.21 -62.76 0.44 Allowed 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.762 0.664 . . . . 10.0 111.113 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 130.59 59.89 0.1 OUTLIER Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 111.654 -0.578 . . . . 10.0 111.654 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 53.6 mtt -97.38 125.93 42.31 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.75 0.31 . . . . 10.0 110.827 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.441 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.6 mm-40 -127.64 -175.39 3.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.878 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.478 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 15.3 tp10 -71.38 138.11 48.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.445 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 64.64 34.34 9.87 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 123.565 0.54 . . . . 10.0 110.723 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.0 OUTLIER -79.53 147.69 32.07 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.24 179.683 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.4 t -103.17 124.64 57.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.987 0.423 . . . . 10.0 111.585 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.4 tt -131.95 147.15 32.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.985 -0.552 . . . . 10.0 109.723 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -107.41 151.55 25.38 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.871 0.367 . . . . 10.0 111.381 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.8 p -135.83 125.83 41.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.887 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -133.18 160.59 36.79 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.31 -0.405 . . . . 10.0 110.73 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.78 133.79 35.14 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.398 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.465 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.9 mm-40 -76.47 150.61 36.65 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.724 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -68.14 -21.68 64.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.939 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.8 p -76.97 -15.05 59.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.949 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.29 5.32 66.42 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 121.105 -0.569 . . . . 10.0 112.296 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.876 0 CA-C-O 118.719 -1.045 . . . . 10.0 111.097 -179.426 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 54.7 t30 . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.655 0.264 . . . . 10.0 111.28 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -122.03 120.03 33.16 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.04 -1.096 . . . . 10.0 108.04 177.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -129.59 129.79 44.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.179 0.514 . . . . 10.0 112.131 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . 0.42 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 27.1 t0 -121.59 128.09 25.78 Favored Pre-proline 0 C--N 1.308 -1.218 0 N-CA-C 107.06 -1.459 . . . . 10.0 107.06 175.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 77.7 Cg_endo -108.86 128.48 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 121.89 1.726 . . . . 10.0 113.695 -178.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.3 mt -120.64 134.6 63.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 114.549 -1.205 . . . . 10.0 110.171 179.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 6.0 t -115.08 135.61 54.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 109.08 -0.711 . . . . 10.0 109.08 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . 0.44 HD12 ' HA ' ' B' ' 364' ' ' ILE . 7.2 tp -114.57 146.06 19.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.503 -0.771 . . . . 10.0 112.423 -176.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -111.2 131.67 54.94 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.468 -0.787 . . . . 10.0 112.529 -174.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . 0.459 ' HA ' ' HD3' ' B' ' 368' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' B' ' 367' ' ' SEP . 25.0 Cg_exo . . . . . 0 C--O 1.247 0.948 0 C-N-CA 122.916 2.411 . . . . 10.0 111.729 178.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 110.063 -0.347 . . . . 10.0 110.063 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.2 mm -111.49 113.23 43.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.325 -0.398 . . . . 10.0 109.962 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.516 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.9 OUTLIER -96.05 109.48 21.89 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.312 0.577 . . . . 10.0 110.282 179.629 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 67.1 mt -95.67 144.01 26.45 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.039 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.5 mtpt -104.43 109.67 21.63 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.896 0.379 . . . . 10.0 110.548 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.454 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.3 t -90.37 128.9 41.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.93 -0.577 . . . . 10.0 109.517 179.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.5 mm -87.98 109.49 19.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.369 -0.378 . . . . 10.0 111.349 -179.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.01 160.29 40.55 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.79 -0.719 . . . . 10.0 111.365 178.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -62.72 -35.84 81.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.89 0.345 . . . . 10.0 111.47 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 17.0 p-10 -88.88 27.94 1.25 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.935 0.397 . . . . 10.0 111.235 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.9 m 61.38 30.54 19.03 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.575 -0.739 . . . . 10.0 111.442 179.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.3 p -82.49 133.31 35.2 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.524 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.527 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 37.0 mt-10 -95.82 96.34 8.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.175 0.512 . . . . 10.0 110.231 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.454 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 2.1 mm -85.68 115.91 27.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.294 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.3 m170 -95.69 96.99 9.37 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.796 -0.446 . . . . 10.0 109.796 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.47 114.46 26.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.641 -179.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -91.25 105.87 18.1 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.195 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.9 m -111.41 170.5 3.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.684 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -117.21 149.31 40.62 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.877 -0.416 . . . . 10.0 109.877 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 60.4 tpp -78.27 69.64 4.51 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.557 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.506 HG22 ' OD2' ' B' ' 366' ' ' ASP . 0.4 OUTLIER 173.87 -29.85 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.587 179.189 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.8 137.64 52.01 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.375 -0.375 . . . . 10.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.0 m80 -70.84 138.51 50.34 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.093 -0.503 . . . . 10.0 109.889 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.9 mt -66.8 -7.63 22.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.495 -0.32 . . . . 10.0 111.758 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -57.94 -49.63 76.11 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 109.905 -0.406 . . . . 10.0 109.905 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.412 ' HZ3' ' P ' ' B' ' 367' ' ' SEP . 30.6 ttpt -70.3 -34.24 72.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.44 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.429 ' HA ' HD13 ' A' ' 47' ' ' LEU . 2.3 mm? -65.17 -44.65 87.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.86 0.362 . . . . 10.0 110.836 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -60.26 -44.63 95.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.967 -0.56 . . . . 10.0 111.66 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.484 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 17.9 pt-20 -74.53 -34.99 63.13 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.697 -0.401 . . . . 10.0 111.221 -179.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.52 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 67.6 m -60.25 -37.36 80.17 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-O 121.072 0.463 . . . . 10.0 110.347 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -64.3 -40.83 96.72 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.562 -0.533 . . . . 10.0 109.562 178.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.414 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 56.7 m -63.93 -39.23 93.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.477 -0.783 . . . . 10.0 110.079 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.52 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 60.4 mt-30 -66.06 -36.06 82.2 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.046 179.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -67.64 -37.77 82.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.672 -0.694 . . . . 10.0 110.774 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -80.79 -29.5 36.09 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.999 0.428 . . . . 10.0 110.797 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 96.26 31.06 7.41 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.831 -0.7 . . . . 10.0 112.242 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.414 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 10.9 m -129.8 155.62 80.18 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 110.182 -0.303 . . . . 10.0 110.182 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -67.25 157.74 60.31 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.375 2.05 . . . . 10.0 111.511 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.403 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 10.6 ttt -67.0 156.4 36.1 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.892 -0.323 . . . . 10.0 111.116 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.3 t30 79.06 -8.5 1.63 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.876 0.87 . . . . 10.0 111.953 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 82.8 p -75.75 -23.7 56.01 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.244 0.545 . . . . 10.0 109.949 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 50.2 mt -116.0 141.33 48.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.482 -0.781 . . . . 10.0 109.981 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' A' ' 63' ' ' ARG . 12.7 ptt180 -113.13 129.19 56.59 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.988 0.423 . . . . 10.0 110.11 179.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -95.99 124.79 40.14 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.825 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.1 mt -115.29 126.16 54.15 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.159 0.505 . . . . 10.0 110.926 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -124.88 100.35 6.56 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.246 -0.888 . . . . 10.0 109.058 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 64.98 33.82 9.43 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.066 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.24 -14.42 62.38 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 115.725 -0.671 . . . . 10.0 113.24 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -97.02 136.0 38.21 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.833 -0.432 . . . . 10.0 109.833 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -83.86 140.03 32.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.096 0.474 . . . . 10.0 110.66 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 50.0 mm -77.35 118.3 23.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.728 -0.669 . . . . 10.0 111.083 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.57 160.32 21.45 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.51 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -64.84 -25.84 68.08 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.378 -0.374 . . . . 10.0 111.5 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -95.59 7.12 47.18 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.431 -0.35 . . . . 10.0 111.659 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 3.6 m170 -78.3 150.26 33.35 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.221 0.534 . . . . 10.0 111.412 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.59 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -132.34 148.66 70.59 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.578 -0.737 . . . . 10.0 110.101 179.254 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -60.38 -17.23 46.16 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.695 2.263 . . . . 10.0 112.569 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -67.01 -33.89 76.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.778 -0.647 . . . . 10.0 110.474 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.59 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.4 pt-20 -96.8 173.77 7.14 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.316 -0.402 . . . . 10.0 109.918 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.433 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 87.6 mt 72.34 -59.15 0.57 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.456 0.703 . . . . 10.0 110.512 -178.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 120.78 87.07 0.95 Allowed Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 121.211 -0.518 . . . . 10.0 111.96 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 62.4 mtt -117.61 132.73 56.46 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.611 0.243 . . . . 10.0 110.415 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -126.67 179.2 5.46 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.817 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.516 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 17.2 tp10 -69.89 137.18 51.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.071 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.468 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 5.4 mm-40 71.93 20.38 4.45 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 123.748 0.655 . . . . 10.0 111.591 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.13 147.17 38.73 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.887 -0.325 . . . . 10.0 110.278 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.9 t -99.02 133.71 40.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.88 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.7 tt -134.99 144.13 35.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 178.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -105.92 155.19 19.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.135 0.493 . . . . 10.0 111.997 -178.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.9 p -139.87 127.19 24.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.458 -0.792 . . . . 10.0 109.326 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -133.64 157.89 44.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.606 -0.27 . . . . 10.0 110.391 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -74.6 133.75 42.16 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.14 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.497 ' OE1' ' HA ' ' A' ' 93' ' ' GLU . 3.9 mm-40 -75.69 155.08 36.05 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.754 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -71.78 -24.99 61.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.46 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.2 p -66.92 -39.25 87.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.149 0.499 . . . . 10.0 110.498 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.44 0.9 75.58 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.768 -0.73 . . . . 10.0 112.195 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.825 -0.986 . . . . 10.0 111.295 -179.983 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 121.2 0.524 . . . . 10.0 110.864 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . 0.527 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 52.3 t30 -116.74 124.39 49.51 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 108.904 -0.776 . . . . 10.0 108.904 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . 0.405 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 16.5 ptt180 -124.69 128.26 48.55 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.45 0.643 . . . . 10.0 111.277 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -120.51 130.37 24.88 Favored Pre-proline 0 C--N 1.314 -0.936 0 N-CA-C 106.631 -1.618 . . . . 10.0 106.631 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -108.23 129.26 0.05 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.331 0 C-N-CA 121.728 1.618 . . . . 10.0 113.317 -178.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.8 mt -116.39 131.8 67.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.379 -1.282 . . . . 10.0 109.352 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 25.9 t -114.96 131.55 66.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.675 0.75 . . . . 10.0 109.43 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' B' ' 364' ' ' ILE . 7.0 tp -115.49 145.34 21.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-N 114.126 -1.397 . . . . 10.0 110.683 -177.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . 0.506 ' OD2' HG22 ' A' ' 41' ' ' THR . 11.5 t70 -108.23 129.16 55.21 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.827 0.822 . . . . 10.0 111.258 -174.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . 0.412 ' P ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . 0.419 ' HD3' ' O ' ' B' ' 366' ' ' ASP . 14.8 Cg_exo . . . . . 0 C--O 1.247 0.928 0 C-N-CA 122.153 1.902 . . . . 10.0 110.992 178.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 . . . . . 0 N--CA 1.478 0.933 0 N-CA-C 110.111 -0.329 . . . . 10.0 110.111 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.8 mm -96.08 113.78 31.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 109.78 -0.452 . . . . 10.0 109.78 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -98.2 115.22 27.89 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.737 0.303 . . . . 10.0 110.497 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 31.1 mt -100.92 145.51 28.55 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.526 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.437 ' HG2' ' CD2' ' A' ' 35' ' ' HIS . 42.0 mtpt -106.58 102.77 12.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.475 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.41 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.9 t -87.37 130.67 36.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 109.541 -0.54 . . . . 10.0 109.541 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.8 mm -102.41 114.61 42.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.893 0.378 . . . . 10.0 110.438 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.17 175.38 54.65 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.801 -0.636 . . . . 10.0 112.705 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 28.7 tp60 -61.42 -29.5 69.98 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 122.57 0.348 . . . . 10.0 111.66 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -97.64 18.97 14.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.817 0.342 . . . . 10.0 110.581 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.3 m 70.37 24.36 4.71 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.469 -0.787 . . . . 10.0 111.893 179.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 p -72.25 137.38 46.76 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.835 -0.432 . . . . 10.0 109.835 179.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.473 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 16.7 mt-10 -100.4 107.08 18.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.182 0.515 . . . . 10.0 110.296 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.41 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 3.6 mm -97.38 118.93 44.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.384 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.437 ' CD2' ' HG2' ' A' ' 25' ' ' LYS . 41.9 m80 -96.35 96.21 8.59 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.994 0.426 . . . . 10.0 110.061 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.4 116.18 28.44 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.311 -0.404 . . . . 10.0 109.939 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -87.32 103.37 15.41 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.09 -0.505 . . . . 10.0 109.859 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.464 HG12 HD11 ' A' ' 47' ' ' LEU . 2.6 m -108.76 169.88 3.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.043 0.449 . . . . 10.0 111.743 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -117.79 143.41 46.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.096 -0.502 . . . . 10.0 109.836 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 54.3 tpp -78.23 65.26 3.54 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.372 0.606 . . . . 10.0 110.199 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 78.6 m -164.04 -46.81 0.03 OUTLIER 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.617 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.536 ' OG1' ' HB2' ' B' ' 366' ' ' ASP . 0.3 OUTLIER -68.29 147.17 52.56 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.427 -0.806 . . . . 10.0 111.611 -179.319 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 43.6 m80 -75.31 151.89 38.24 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.659 -0.496 . . . . 10.0 109.659 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.7 mt -70.95 -10.74 60.23 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.455 -0.339 . . . . 10.0 111.492 -179.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.59 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 41.8 tttp -63.06 -47.91 80.95 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.978 -0.379 . . . . 10.0 109.978 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -56.28 -40.61 74.54 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.948 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.464 HD11 HG12 ' A' ' 38' ' ' VAL . 3.6 mm? -64.03 -40.67 96.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.781 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -66.75 -47.25 72.84 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.923 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -69.81 -36.11 75.36 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.045 0.387 . . . . 10.0 112.045 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 49.4 m -75.59 -29.98 59.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.628 0.251 . . . . 10.0 111.397 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -65.14 -36.38 84.08 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.966 0.412 . . . . 10.0 110.512 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 63.2 m -60.02 -31.69 70.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.673 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -69.96 -31.25 68.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.901 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -67.76 -37.19 81.78 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.679 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -89.27 -14.32 36.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.352 -0.386 . . . . 10.0 111.269 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.94 36.14 29.16 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.896 -0.669 . . . . 10.0 112.392 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 3.1 m -123.71 159.78 54.21 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 110.561 -0.163 . . . . 10.0 110.561 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -68.27 167.22 22.73 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.221 1.947 . . . . 10.0 111.733 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.46 140.23 57.08 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.209 -179.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.8 t30 69.83 22.17 6.08 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.251 -0.886 . . . . 10.0 112.632 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.9 p -87.82 -23.17 24.11 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.44 0.638 . . . . 10.0 109.358 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 37.2 mt -117.69 134.98 54.33 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.372 -0.831 . . . . 10.0 109.786 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.429 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.2 ptt-85 -104.03 127.27 51.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.121 0.486 . . . . 10.0 110.393 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.458 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 87.4 m-85 -90.13 123.71 34.2 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.475 -0.784 . . . . 10.0 109.983 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.3 mt -110.51 118.35 36.01 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.106 0.479 . . . . 10.0 111.019 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -125.61 116.28 21.47 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.353 -0.84 . . . . 10.0 108.793 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 64.9 25.3 12.78 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.125 0.488 . . . . 10.0 110.737 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.19 -9.63 76.18 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.722 -0.672 . . . . 10.0 112.909 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -107.14 145.27 32.73 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 122.649 -0.324 . . . . 10.0 110.389 -179.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.458 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 14.2 ptm180 -82.5 137.03 34.74 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.234 0.54 . . . . 10.0 110.706 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.2 mm -71.64 119.92 18.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.848 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -74.32 164.22 26.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.427 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.59 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 0.1 OUTLIER -78.34 -1.8 35.04 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.985 0.421 . . . . 10.0 111.501 -179.016 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -121.87 16.1 10.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.254 0.55 . . . . 10.0 110.301 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -84.13 148.11 26.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.238 -179.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.555 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.3 OUTLIER -119.24 145.31 38.12 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.516 -0.765 . . . . 10.0 109.465 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.462 ' HD2' HG22 ' A' ' 76' ' ' THR . 31.2 Cg_exo -60.42 -16.07 39.58 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.415 2.076 . . . . 10.0 112.574 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -69.35 -42.86 74.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.741 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 76' ' ' THR . 8.8 pt-20 -84.25 177.26 8.26 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.432 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 11.0 mt 72.94 -54.62 0.69 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.1 0.56 . . . . 10.0 110.773 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 119.2 64.13 0.28 Allowed Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.976 -0.63 . . . . 10.0 112.652 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 47.9 mtt -97.79 135.04 40.13 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.828 0.347 . . . . 10.0 110.586 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 4.9 mm-40 -133.19 -176.29 4.08 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.2 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 38.8 tp10 -71.09 139.71 50.44 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.663 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 65.65 25.42 11.58 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.209 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -72.27 156.74 38.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.44 -0.345 . . . . 10.0 110.242 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.5 t -111.45 130.94 64.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.894 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.445 HD11 ' HB3' ' A' ' 64' ' ' PHE . 18.0 tt -137.15 142.31 37.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -102.35 150.69 23.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.89 0.376 . . . . 10.0 111.451 -178.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -131.61 124.61 54.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.877 -0.602 . . . . 10.0 109.533 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -127.36 158.16 38.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.425 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -87.63 130.92 34.61 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.865 0.364 . . . . 10.0 111.636 -178.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.429 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 6.4 mm-40 -71.9 143.5 49.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.879 -0.601 . . . . 10.0 109.97 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -68.32 -25.69 65.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.059 -0.519 . . . . 10.0 111.493 -179.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 32.5 p -71.88 -28.47 63.54 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.937 0.398 . . . . 10.0 110.967 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 80.61 10.4 85.27 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.937 -0.649 . . . . 10.0 111.98 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.949 0 CA-C-O 118.84 -0.978 . . . . 10.0 111.322 -179.862 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 55.7 t30 . . . . . 0 N--CA 1.483 1.186 0 CA-C-O 121.134 0.493 . . . . 10.0 110.26 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 50.1 t30 -120.69 123.76 43.52 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.557 -0.905 . . . . 10.0 108.557 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -125.91 127.08 45.44 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . 0.427 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 20.6 t0 -122.71 128.7 25.3 Favored Pre-proline 0 C--N 1.318 -0.776 0 N-CA-C 107.394 -1.336 . . . . 10.0 107.394 176.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 57.9 Cg_endo -111.14 128.79 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.184 0 C-N-CA 121.728 1.619 . . . . 10.0 113.638 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 4.2 mt -119.67 136.93 55.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 113.702 -1.59 . . . . 10.0 109.732 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -113.07 135.77 51.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.394 0.616 . . . . 10.0 109.643 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 5.2 tp -113.16 144.16 21.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.272 -0.876 . . . . 10.0 111.765 -176.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . 0.536 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 0.2 OUTLIER -113.77 131.32 56.25 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.968 -1.015 . . . . 10.0 112.026 -175.455 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . 0.403 ' HA ' ' HD3' ' B' ' 368' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' B' ' 367' ' ' SEP . 50.8 Cg_exo . . . . . 0 C--O 1.25 1.077 0 C-N-CA 123.211 2.607 . . . . 10.0 112.712 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 110.126 -0.324 . . . . 10.0 110.126 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.422 ' HB ' HG22 ' A' ' 38' ' ' VAL . 31.6 mm -102.79 108.98 25.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.431 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -93.87 96.3 9.65 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.207 0.527 . . . . 10.0 110.61 -179.301 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 45.0 mt -82.23 149.83 27.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.614 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -105.82 107.89 19.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.24 -0.437 . . . . 10.0 110.201 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.497 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.8 t -89.3 121.83 39.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.371 -0.603 . . . . 10.0 109.371 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.0 mm -86.83 110.85 20.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.904 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.82 159.77 44.26 Favored Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 120.871 -0.68 . . . . 10.0 111.553 179.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -62.68 -32.23 73.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.737 0.269 . . . . 10.0 111.525 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -91.75 27.65 2.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.883 0.373 . . . . 10.0 111.342 -179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.9 m 62.56 37.95 12.76 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.777 -0.647 . . . . 10.0 111.179 179.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.85 143.53 26.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.855 -0.611 . . . . 10.0 109.916 179.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.455 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 20.9 mt-10 -109.14 97.43 7.04 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.114 0.483 . . . . 10.0 110.654 -179.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.497 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 3.0 mm -87.28 127.06 40.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.907 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -103.22 102.6 12.59 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.021 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.19 116.39 30.31 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.7 ttmt -87.44 95.13 9.9 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.76 -0.655 . . . . 10.0 109.611 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.429 HG12 HD11 ' A' ' 47' ' ' LEU . 3.1 m -101.06 163.95 2.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.461 . . . . 10.0 111.516 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -113.83 142.4 46.14 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.869 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.405 ' O ' ' HB ' ' A' ' 41' ' ' THR . 54.3 tpp -80.42 76.8 7.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.999 0.428 . . . . 10.0 111.663 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.405 ' HB ' ' O ' ' A' ' 40' ' ' MET . 8.3 t 173.68 -35.54 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.883 178.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.21 132.65 42.37 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.14 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.7 m80 -64.69 155.95 31.85 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.034 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.402 HD12 ' HB3' ' A' ' 75' ' ' HIS . 48.3 mt -74.51 -0.9 19.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.737 0.303 . . . . 10.0 110.687 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.537 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 12.2 tptp -59.62 -57.33 13.42 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.403 ' HG3' HD11 ' B' ' 364' ' ' ILE . 4.7 tppp? -59.15 -35.39 73.42 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.482 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.429 HD11 HG12 ' A' ' 38' ' ' VAL . 4.3 mm? -64.67 -48.16 75.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.044 -0.525 . . . . 10.0 111.679 -179.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -58.39 -48.46 80.58 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.951 0.352 . . . . 10.0 111.951 -179.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 4.6 pt-20 -70.58 -31.37 68.35 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.015 0.376 . . . . 10.0 112.015 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.0 m -71.95 -36.91 70.01 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.942 -0.303 . . . . 10.0 110.974 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -64.98 -39.34 93.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.852 0.358 . . . . 10.0 110.092 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.419 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 58.6 m -62.1 -36.08 80.64 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 178.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -66.85 -39.12 87.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.348 179.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -63.38 -41.23 98.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.616 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -78.2 -16.42 57.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.817 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.03 31.83 41.81 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.888 -0.672 . . . . 10.0 112.431 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.7 m -128.34 158.06 72.61 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 110.648 -0.13 . . . . 10.0 110.648 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -64.98 161.62 36.02 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.37 2.046 . . . . 10.0 111.311 178.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.419 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 21.6 ttt -72.22 152.25 42.34 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.038 -0.265 . . . . 10.0 111.124 -179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 11.7 t30 79.13 -3.57 2.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.024 0.93 . . . . 10.0 111.924 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 81.1 p -78.28 -18.23 55.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.255 0.55 . . . . 10.0 109.795 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 56.9 mt -120.84 135.35 55.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.16 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.501 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 10.7 ptt180 -105.38 125.28 50.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.045 0.45 . . . . 10.0 110.323 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -88.28 117.59 27.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.885 179.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.3 mt -107.52 123.6 48.67 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.123 0.487 . . . . 10.0 110.346 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -127.27 98.61 5.34 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.582 -0.735 . . . . 10.0 109.839 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 62.29 49.13 4.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.279 -0.873 . . . . 10.0 111.351 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.02 -50.87 2.51 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.962 -0.637 . . . . 10.0 113.49 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -80.38 163.19 24.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.868 0.366 . . . . 10.0 111.34 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -101.91 152.4 20.96 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.375 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 46.2 mm -82.33 121.26 35.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.96 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -79.56 163.78 24.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.994 -0.548 . . . . 10.0 109.883 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.67 -21.0 61.14 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.837 0.351 . . . . 10.0 111.706 -179.204 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -100.83 5.37 43.43 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.697 -0.228 . . . . 10.0 111.235 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.402 ' HB3' HD12 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -74.65 149.03 40.15 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.599 -179.645 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 23.9 p -123.23 157.42 61.22 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.109 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -69.0 -8.06 22.55 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.514 2.143 . . . . 10.0 112.253 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -79.25 -35.97 40.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.773 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.473 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 7.8 pt-20 -92.21 173.03 8.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.037 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.473 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 52.2 mt 73.78 -42.39 0.51 Allowed 'General case' 0 N--CA 1.469 0.519 0 O-C-N 123.692 0.62 . . . . 10.0 110.947 -179.204 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 105.41 84.95 1.79 Allowed Glycine 0 N--CA 1.444 -0.824 0 C-N-CA 121.174 -0.536 . . . . 10.0 112.362 179.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 52.5 mtt -114.88 148.26 38.84 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.847 -0.427 . . . . 10.0 109.847 179.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.9 mm-40 -146.12 174.67 11.1 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.954 0.406 . . . . 10.0 110.971 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.431 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 20.7 tp10 -65.9 135.5 54.86 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.896 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 18.5 mm-40 69.26 25.65 5.58 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 123.574 0.546 . . . . 10.0 111.558 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.3 t0 -71.92 167.2 20.57 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.824 -0.351 . . . . 10.0 110.091 179.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.0 t -113.9 117.57 55.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 120.912 0.387 . . . . 10.0 111.836 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 16.9 tt -125.72 139.54 51.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.812 -0.631 . . . . 10.0 109.32 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -113.25 146.63 39.03 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.865 0.364 . . . . 10.0 111.1 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.2 p -133.92 130.76 55.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.145 -0.48 . . . . 10.0 109.811 179.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -134.49 166.6 22.5 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.34 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -76.29 141.47 41.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.685 0.278 . . . . 10.0 110.813 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.501 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 1.1 mm-40 -86.41 151.27 23.68 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.368 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -72.61 -22.08 61.01 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.231 0.539 . . . . 10.0 110.262 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -30.79 69.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.585 -0.734 . . . . 10.0 110.843 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 88.08 -9.99 72.58 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.892 -0.67 . . . . 10.0 113.051 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.837 0 CA-C-O 118.492 -1.171 . . . . 10.0 111.633 -179.807 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 121.075 0.464 . . . . 10.0 110.599 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -119.7 122.51 41.64 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.607 -0.437 . . . . 10.0 109.88 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . 0.455 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 14.7 ptt180 -124.94 128.59 48.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.247 0.546 . . . . 10.0 112.309 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . 0.425 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 32.4 t0 -123.41 128.57 25.19 Favored Pre-proline 0 C--N 1.32 -0.708 0 N-CA-C 107.601 -1.259 . . . . 10.0 107.601 177.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 67.3 Cg_endo -107.91 127.61 0.05 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 121.545 1.497 . . . . 10.0 112.868 -179.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 3.0 mt -117.9 136.96 53.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 114.364 -1.289 . . . . 10.0 110.186 -178.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 40.7 t -112.54 135.57 51.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.477 0.656 . . . . 10.0 110.312 -178.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . 0.403 HD11 ' HG3' ' A' ' 46' ' ' LYS . 7.9 tp -112.31 144.83 19.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 114.444 -1.253 . . . . 10.0 110.729 -177.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -114.24 131.29 56.53 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.829 -1.078 . . . . 10.0 111.313 -176.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . 0.413 ' HA ' ' HD3' ' B' ' 368' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' B' ' 367' ' ' SEP . 75.2 Cg_exo . . . . . 0 C--O 1.251 1.149 0 C-N-CA 123.479 2.786 . . . . 10.0 113.145 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.688 0.28 . . . . 10.0 110.357 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.1 mm -100.95 116.84 45.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.634 ' HE2' ' ND1' ' A' ' 35' ' ' HIS . 0.4 OUTLIER -100.43 105.56 17.05 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.119 0.485 . . . . 10.0 110.763 -179.481 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.8 mt -88.57 150.85 22.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.21 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 44.1 mtpt -110.19 119.59 39.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.0 0.429 . . . . 10.0 110.454 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.7 t -102.11 131.35 50.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.712 -0.677 . . . . 10.0 109.44 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.8 mm -101.33 118.31 47.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.899 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.4 155.81 25.36 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.981 -0.628 . . . . 10.0 112.153 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -65.79 -20.73 66.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.008 0.432 . . . . 10.0 111.053 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -89.84 12.59 16.81 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.777 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.9 m 71.22 39.58 0.94 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.533 -0.758 . . . . 10.0 111.578 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 20.7 p -102.84 140.52 37.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.243 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -107.91 99.46 8.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.121 0.486 . . . . 10.0 109.985 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.0 mm -89.04 134.22 29.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.151 -178.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.634 ' ND1' ' HE2' ' A' ' 23' ' ' LYS . 97.5 m-70 -111.44 105.97 14.74 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.603 -0.518 . . . . 10.0 109.603 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -104.02 117.62 34.73 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.875 0.369 . . . . 10.0 110.487 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.9 ttmt -89.58 100.5 13.29 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.119 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 m -103.2 170.18 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.515 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -121.2 142.73 49.62 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 110.079 -0.341 . . . . 10.0 110.079 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.467 ' O ' ' HB ' ' A' ' 41' ' ' THR . 48.7 tpp -74.96 71.39 2.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.442 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.467 ' HB ' ' O ' ' A' ' 40' ' ' MET . 10.1 t 171.86 -29.96 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.278 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.08 139.48 44.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.205 -179.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -68.02 137.57 55.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.231 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.477 HD12 ' HB3' ' A' ' 75' ' ' HIS . 63.9 mt -68.08 -9.23 44.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.347 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.0 tptt -58.53 -47.1 85.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.297 0.57 . . . . 10.0 109.471 178.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.3 tppp? -65.42 -34.46 78.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.236 -0.893 . . . . 10.0 110.539 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.414 HD13 ' HA ' ' A' ' 47' ' ' LEU . 4.3 mm? -68.66 -45.32 72.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.822 -0.626 . . . . 10.0 111.173 -179.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -61.56 -45.67 93.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.812 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.433 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 11.1 pt-20 -70.08 -40.27 75.09 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.937 -0.305 . . . . 10.0 111.371 -179.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.3 m -61.91 -34.82 76.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.818 0.342 . . . . 10.0 110.772 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -65.79 -40.73 92.24 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.673 -0.492 . . . . 10.0 109.673 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 57.9 m -63.92 -39.78 94.95 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.255 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 49' ' ' GLU . 79.7 mt-30 -65.26 -41.62 94.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.411 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -64.77 -37.45 87.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.938 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.424 ' HB2' HG22 ' A' ' 57' ' ' VAL . 15.0 mm100 -85.75 -3.32 58.87 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.03 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.3 39.65 98.08 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 121.234 -0.507 . . . . 10.0 112.516 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.424 HG22 ' HB2' ' A' ' 55' ' ' GLN . 4.3 m -124.14 156.2 66.69 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.474 ' HG2' ' HB3' ' A' ' 61' ' ' SER . 11.0 Cg_endo -58.36 165.41 7.48 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.697 2.264 . . . . 10.0 112.431 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 22.4 ttt -69.1 132.28 46.33 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.617 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.0 t30 66.29 25.5 10.49 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.271 -0.877 . . . . 10.0 111.996 179.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.474 ' HB3' ' HG2' ' A' ' 58' ' ' PRO . 12.6 p -77.32 -22.32 52.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.564 0.697 . . . . 10.0 109.816 178.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.9 mt -117.92 141.59 48.27 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.082 -0.963 . . . . 10.0 110.372 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.441 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 20.5 ptt-85 -104.87 128.7 53.17 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.751 178.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -94.5 123.97 38.24 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.163 -0.472 . . . . 10.0 110.014 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.7 mt -112.26 121.6 45.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.894 -179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -124.15 113.56 18.5 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.365 -0.834 . . . . 10.0 108.866 178.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.401 ' OE1' ' HA ' ' A' ' 67' ' ' GLU . 4.1 mm-40 63.12 28.75 16.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.253 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 88.0 -4.89 85.47 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 121.088 -0.577 . . . . 10.0 113.126 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -109.33 145.96 35.15 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.948 -0.39 . . . . 10.0 109.948 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -85.86 139.54 31.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.194 0.521 . . . . 10.0 110.795 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.5 mm -74.91 121.5 26.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.538 -0.755 . . . . 10.0 110.881 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -75.29 164.39 26.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.014 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.87 -27.09 60.11 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.698 0.285 . . . . 10.0 111.089 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 -99.99 22.88 10.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.962 0.411 . . . . 10.0 110.562 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.477 ' HB3' HD12 ' A' ' 44' ' ' LEU . 1.5 m170 -85.03 157.05 20.85 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.109 0.481 . . . . 10.0 111.309 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.548 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.2 OUTLIER -134.56 152.3 77.55 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.712 -0.676 . . . . 10.0 109.742 179.108 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -63.11 -13.15 33.67 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.583 2.189 . . . . 10.0 113.013 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.0 tppt? -69.63 -40.98 76.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.441 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.548 ' HG2' ' O ' ' A' ' 76' ' ' THR . 7.6 pt-20 -85.36 169.01 14.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.095 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 22.8 mt 73.78 -60.06 0.54 Allowed 'General case' 0 N--CA 1.468 0.427 0 O-C-N 123.828 0.705 . . . . 10.0 110.599 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 119.79 76.76 0.49 Allowed Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.936 -0.65 . . . . 10.0 112.177 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 65.1 mtt -104.08 118.04 35.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.726 0.298 . . . . 10.0 110.489 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.452 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 17.4 mm-40 -112.51 -177.67 3.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.663 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.49 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 38.6 tp10 -73.85 140.62 45.86 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.224 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 20.3 mm-40 70.49 20.79 5.8 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.638 0.586 . . . . 10.0 111.009 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.6 OUTLIER -71.98 150.24 44.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.077 179.568 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 40.2 t -109.4 122.28 63.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.079 0.466 . . . . 10.0 111.572 -178.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.8 tt -121.65 142.15 39.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -102.58 145.8 29.09 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.711 0.291 . . . . 10.0 111.353 -178.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.4 p -130.46 125.55 59.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.188 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -133.66 156.57 47.67 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.223 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.67 142.24 38.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.79 0.329 . . . . 10.0 111.219 -179.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.441 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.9 mm-40 -81.18 149.62 29.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.411 179.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -66.43 -37.15 84.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.106 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 6.4 p -76.38 -12.27 60.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.498 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 84.94 -10.22 63.54 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.835 -0.698 . . . . 10.0 112.092 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.939 0 N-CA-C 110.922 -0.871 . . . . 10.0 110.922 -179.834 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 . . . . . 0 N--CA 1.479 1.023 0 CA-C-O 121.359 0.599 . . . . 10.0 110.35 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -118.5 126.69 52.55 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 108.179 -1.045 . . . . 10.0 108.179 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -124.86 128.07 48.11 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 113.162 0.801 . . . . 10.0 113.162 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -124.0 127.43 25.39 Favored Pre-proline 0 C--N 1.314 -0.943 0 N-CA-C 107.429 -1.323 . . . . 10.0 107.429 175.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -109.81 127.85 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.22 0 C-N-CA 121.779 1.652 . . . . 10.0 113.021 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.5 mt -118.64 136.01 57.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 114.182 -1.372 . . . . 10.0 110.056 -179.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 13.6 t -113.02 137.2 46.82 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 108.972 -0.751 . . . . 10.0 108.972 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . 0.409 ' HA ' HD12 ' B' ' 364' ' ' ILE . 6.4 tp -110.82 147.46 14.89 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 114.867 -1.061 . . . . 10.0 111.696 -176.021 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -111.74 128.05 55.97 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.871 -1.058 . . . . 10.0 110.649 -176.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . 0.414 ' HA ' ' HD3' ' B' ' 368' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' B' ' 367' ' ' SEP . 51.6 Cg_exo . . . . . 0 C--O 1.246 0.92 0 C-N-CA 123.017 2.478 . . . . 10.0 112.179 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.3 mm -105.48 114.01 43.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.379 -0.6 . . . . 10.0 109.379 179.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.436 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.7 ttpm? -99.62 103.05 14.73 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.029 0.442 . . . . 10.0 110.506 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 21.8 mt -88.2 153.13 21.48 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.716 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.9 mtpt -107.41 111.15 23.33 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.297 -0.41 . . . . 10.0 109.982 179.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.433 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.6 t -95.41 125.82 48.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.874 -0.603 . . . . 10.0 109.62 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.1 mm -95.83 118.87 43.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 120.966 0.413 . . . . 10.0 110.63 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.76 164.75 36.03 Favored Glycine 0 N--CA 1.448 -0.541 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.815 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -62.27 -27.96 69.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.651 0.263 . . . . 10.0 111.378 -179.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -91.56 24.4 3.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.451 -0.34 . . . . 10.0 110.808 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.1 m 61.83 38.37 14.77 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.873 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -93.33 145.02 24.77 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.969 -0.56 . . . . 10.0 109.831 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.501 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 4.3 mt-10 -113.48 98.42 7.07 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.228 0.537 . . . . 10.0 110.337 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.433 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 3.8 mm -87.13 128.13 40.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.723 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.9 m170 -99.13 94.58 6.58 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.633 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.75 113.31 25.35 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.833 0.349 . . . . 10.0 110.21 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -92.68 103.93 16.26 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.418 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 m -104.38 170.15 2.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.871 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -119.0 139.99 50.77 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 56.8 tpp -76.81 62.7 2.08 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.167 0.508 . . . . 10.0 110.379 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 m -163.15 -38.19 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.219 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.435 ' OG1' ' HB2' ' B' ' 366' ' ' ASP . 0.2 OUTLIER -80.85 152.24 28.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.721 -0.672 . . . . 10.0 112.172 -178.954 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -80.67 152.69 28.32 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.551 -0.749 . . . . 10.0 109.536 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.9 mt -69.66 -6.7 33.24 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.813 0.301 . . . . 10.0 111.813 -179.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.418 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 50.0 tptt -60.15 -51.31 70.14 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.827 -0.434 . . . . 10.0 109.827 178.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.424 ' HG3' HD11 ' B' ' 364' ' ' ILE . 4.8 tppp? -62.63 -33.51 75.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.539 -0.755 . . . . 10.0 110.651 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.51 -47.13 67.78 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.07 -0.514 . . . . 10.0 111.57 -179.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -61.82 -45.19 94.92 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.07 0.396 . . . . 10.0 112.07 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 9.8 pt-20 -68.78 -35.14 76.68 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.75 0.278 . . . . 10.0 111.75 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 64.6 m -68.68 -33.02 73.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.755 0.312 . . . . 10.0 110.712 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.432 ' CG ' ' HZ ' ' A' ' 64' ' ' PHE . 30.5 t80 -68.54 -42.25 78.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.937 0.398 . . . . 10.0 110.185 179.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 56.0 m -60.91 -41.82 96.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.954 -0.567 . . . . 10.0 110.216 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -67.08 -30.76 70.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.79 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -69.47 -39.71 77.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.651 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -82.26 -15.75 51.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.257 -0.429 . . . . 10.0 111.216 -179.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.07 39.15 10.32 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.653 -0.784 . . . . 10.0 112.387 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.2 m -135.85 153.49 77.19 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 110.08 -0.341 . . . . 10.0 110.08 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -66.29 159.1 51.64 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.232 1.954 . . . . 10.0 111.103 178.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.41 ' SD ' ' HB3' ' A' ' 49' ' ' GLU . 17.2 ttt -68.03 159.53 30.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.714 0.292 . . . . 10.0 111.252 -179.265 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.0 t30 79.7 -16.9 0.62 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.163 0.985 . . . . 10.0 111.743 179.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 81.0 p -68.49 -37.73 80.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.122 0.487 . . . . 10.0 110.026 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 94.1 mt -102.6 125.33 49.29 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.577 -0.738 . . . . 10.0 110.308 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.504 ' HD3' ' OE2' ' A' ' 93' ' ' GLU . 18.2 ptt180 -106.18 124.78 50.12 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.145 0.498 . . . . 10.0 110.417 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.432 ' HZ ' ' CG ' ' A' ' 51' ' ' TYR . 50.7 m-85 -86.51 126.61 34.56 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.483 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 82.5 mt -113.43 127.7 56.2 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.174 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -135.38 115.72 13.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.464 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 62.3 29.36 17.32 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.529 0.518 . . . . 10.0 110.925 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.32 -37.23 3.48 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.967 -0.635 . . . . 10.0 112.885 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -81.02 158.72 25.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.7 0.286 . . . . 10.0 110.621 -179.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.0 ptm180 -96.54 140.66 30.84 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.979 0.419 . . . . 10.0 110.174 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.0 mm -74.15 123.95 30.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.414 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.58 166.9 17.82 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.51 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -81.08 -3.25 51.29 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.933 -178.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.7 p-10 -115.88 4.79 13.93 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.841 0.353 . . . . 10.0 110.624 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 21.5 m170 -78.45 152.57 32.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.398 -179.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.495 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 11.2 p -123.41 153.98 65.75 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.172 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -66.6 -14.28 43.35 Favored 'Trans proline' 0 N--CA 1.472 0.236 0 C-N-CA 122.484 2.123 . . . . 10.0 112.639 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -73.93 -30.65 62.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.538 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 76' ' ' THR . 13.9 pt-20 -98.6 173.49 6.9 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.738 -0.467 . . . . 10.0 109.738 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.432 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 58.4 mt 73.01 -46.96 0.66 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 123.634 0.584 . . . . 10.0 111.235 -179.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 112.4 77.03 0.81 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 121.092 -0.575 . . . . 10.0 112.732 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 56.5 mtt -111.67 115.72 29.59 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.748 0.308 . . . . 10.0 110.35 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 25.1 mm-40 -114.35 177.62 4.58 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.069 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.439 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 29.1 tp10 -69.7 139.11 53.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.076 179.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 13.1 mm-40 70.57 11.85 7.32 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 123.483 0.49 . . . . 10.0 111.927 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.3 OUTLIER -68.8 147.61 51.51 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.97 -0.292 . . . . 10.0 110.309 179.705 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 92.6 t -98.1 126.39 51.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 121.241 0.543 . . . . 10.0 111.59 -178.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.5 tt -126.39 142.9 41.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.53 -0.759 . . . . 10.0 109.136 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -108.18 157.21 18.51 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.101 0.477 . . . . 10.0 111.841 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.4 p -146.85 125.39 4.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.436 178.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -133.98 169.38 17.2 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.387 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -81.58 134.65 35.52 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.848 0.356 . . . . 10.0 110.965 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.504 ' OE2' ' HD3' ' A' ' 63' ' ' ARG . 2.6 mm-40 -69.42 173.91 5.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.565 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -78.44 -31.35 48.01 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.921 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 16.6 p -72.46 -33.32 66.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.568 -0.742 . . . . 10.0 111.321 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.78 6.32 80.03 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 110.96 -0.856 . . . . 10.0 110.96 -178.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.978 0 N-CA-C 110.716 -0.953 . . . . 10.0 110.716 -179.788 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 66.3 t30 . . . . . 0 N--CA 1.483 1.177 0 CA-C-O 121.283 0.563 . . . . 10.0 110.988 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . 0.501 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 5.9 t-20 -120.34 121.09 37.83 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 108.468 -0.938 . . . . 10.0 108.468 178.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . 0.44 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 16.8 ptt180 -128.66 129.57 46.02 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 113.327 0.862 . . . . 10.0 113.327 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -122.54 130.44 24.66 Favored Pre-proline 0 C--N 1.317 -0.823 0 N-CA-C 107.872 -1.159 . . . . 10.0 107.872 176.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -108.36 127.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 121.246 1.297 . . . . 10.0 113.719 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.2 mt -119.26 135.08 60.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 114.407 -1.27 . . . . 10.0 109.93 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 21.0 t -114.49 135.24 54.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 N-CA-C 109.014 -0.735 . . . . 10.0 109.014 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . 0.424 HD11 ' HG3' ' A' ' 46' ' ' LYS . 6.5 tp -113.78 144.43 21.4 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 CA-C-N 115.082 -0.963 . . . . 10.0 111.502 -176.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . 0.403 ' P ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . 0.435 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 4.7 t70 -112.09 130.15 55.98 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.123 -0.944 . . . . 10.0 111.836 -175.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . 0.448 ' HA ' ' HD3' ' B' ' 368' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' B' ' 367' ' ' SEP . 16.2 Cg_exo . . . . . 0 C--O 1.248 0.994 0 C-N-CA 122.591 2.194 . . . . 10.0 110.96 178.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 110.382 -0.229 . . . . 10.0 110.382 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.5 mm -110.95 118.87 58.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -100.4 108.71 20.78 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.119 0.485 . . . . 10.0 111.624 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.8 mt -91.46 147.66 22.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.546 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt -105.25 104.58 14.33 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.077 0.465 . . . . 10.0 110.363 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.45 ' O ' HG12 ' A' ' 34' ' ' ILE . 3.6 t -87.77 125.97 41.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.685 -0.689 . . . . 10.0 109.369 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.6 mm -99.44 116.05 41.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 120.888 0.375 . . . . 10.0 110.575 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.84 169.66 42.81 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.719 -0.753 . . . . 10.0 111.93 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -60.02 -33.17 71.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.357 . . . . 10.0 111.486 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -86.69 23.25 1.72 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.572 -179.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 72.2 m 61.37 32.21 19.13 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.259 0.552 . . . . 10.0 111.066 179.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.03 140.1 31.28 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.73 -0.668 . . . . 10.0 109.714 179.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.491 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 12.8 mt-10 -107.62 96.47 6.42 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.106 0.479 . . . . 10.0 110.251 -179.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 26' ' ' VAL . 1.2 mm -82.66 127.44 39.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.657 -179.169 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -96.17 87.68 4.6 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.36 106.26 17.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.336 -179.251 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -92.2 104.69 17.03 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.946 0.403 . . . . 10.0 110.701 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 5.1 m -103.45 167.16 2.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.202 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 64.8 tttt -117.31 137.8 52.19 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 110.164 -0.31 . . . . 10.0 110.164 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.438 ' O ' ' HB ' ' A' ' 41' ' ' THR . 57.6 tpp -75.11 76.13 2.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.014 0.435 . . . . 10.0 110.711 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.438 ' HB ' ' O ' ' A' ' 40' ' ' MET . 8.7 t 173.13 -30.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.127 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.67 145.86 28.56 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.406 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -76.43 147.32 38.03 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.189 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.416 HD12 ' HB3' ' A' ' 75' ' ' HIS . 49.2 mt -69.02 -7.33 34.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.951 0.405 . . . . 10.0 110.657 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 28.2 tptt -56.15 -52.58 63.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.24 178.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.462 ' HZ3' ' P ' ' B' ' 367' ' ' SEP . 23.4 ttpt -69.9 -32.83 71.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.685 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.473 ' HA ' HD13 ' A' ' 47' ' ' LEU . 3.3 mm? -63.87 -39.47 94.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.273 -0.421 . . . . 10.0 111.045 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -61.69 -44.27 97.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.67 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -76.03 -28.67 57.81 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 121.017 -0.273 . . . . 10.0 111.368 -179.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.411 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 66.4 m -63.24 -38.7 92.18 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.952 0.406 . . . . 10.0 111.008 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -67.07 -35.33 79.59 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.898 -0.408 . . . . 10.0 109.898 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.474 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.9 m -62.19 -40.57 96.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.736 -0.666 . . . . 10.0 109.895 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.411 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.3 mt-30 -64.21 -41.08 97.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.527 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -66.95 -32.41 73.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.176 -0.466 . . . . 10.0 110.678 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -84.84 -11.85 54.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.129 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.93 32.31 63.69 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.994 -0.622 . . . . 10.0 112.266 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.9 m -131.37 154.59 81.96 Favored Pre-proline 0 C--N 1.324 -0.543 0 N-CA-C 110.54 -0.171 . . . . 10.0 110.54 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -64.27 164.29 23.37 Favored 'Trans proline' 0 CA--C 1.53 0.277 0 C-N-CA 122.449 2.099 . . . . 10.0 111.577 178.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.474 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 11.6 ttt -72.61 157.83 36.82 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 121.236 -0.186 . . . . 10.0 110.934 -179.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.3 t30 75.12 5.35 4.25 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.525 0.73 . . . . 10.0 111.947 178.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 55.6 p -86.69 -26.36 24.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.371 0.605 . . . . 10.0 109.926 179.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 48.7 mt -117.35 143.23 46.18 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.406 -0.815 . . . . 10.0 110.678 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.522 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 14.2 ptt-85 -115.42 127.7 55.54 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.284 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.459 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 25.3 m-85 -90.37 121.72 32.61 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.061 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 55.4 mt -107.94 111.44 23.54 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.128 0.489 . . . . 10.0 110.709 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -121.7 121.84 38.23 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.409 -0.814 . . . . 10.0 109.022 179.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 63.2 19.34 11.61 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.434 0.459 . . . . 10.0 110.962 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.62 -21.86 43.88 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.925 -0.655 . . . . 10.0 112.585 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -98.14 161.23 13.82 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.572 0.225 . . . . 10.0 110.636 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.459 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 13.3 ptm180 -95.46 143.45 26.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.017 0.437 . . . . 10.0 110.698 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.3 mm -77.95 127.36 38.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.646 -0.706 . . . . 10.0 111.803 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.94 166.44 13.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.33 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.479 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -73.35 -13.64 61.14 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.659 0.266 . . . . 10.0 111.521 -179.284 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -105.64 10.7 32.84 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.791 0.329 . . . . 10.0 111.229 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.416 ' HB3' HD12 ' A' ' 44' ' ' LEU . 1.6 m170 -83.65 149.03 26.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.102 0.477 . . . . 10.0 111.124 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.421 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -129.42 148.09 67.82 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.692 178.888 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 76' ' ' THR . 24.3 Cg_exo -64.32 -6.69 12.21 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.718 2.279 . . . . 10.0 112.798 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.9 tppt? -75.15 -27.27 59.65 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.902 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 76' ' ' THR . 3.2 pt-20 -108.69 -174.99 2.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.556 -179.397 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 41.0 mt 72.17 -58.49 0.59 Allowed 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.894 0.746 . . . . 10.0 110.922 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 129.36 61.16 0.1 Allowed Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 111.693 -0.563 . . . . 10.0 111.693 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 39.8 mtt -98.16 126.22 43.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.935 0.398 . . . . 10.0 110.644 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.493 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -129.84 173.27 10.83 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.364 179.893 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -66.17 138.33 57.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.235 -0.439 . . . . 10.0 109.834 179.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 69.63 25.89 5.13 Favored 'General case' 0 C--O 1.233 0.198 0 O-C-N 123.65 0.594 . . . . 10.0 111.546 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.493 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.6 OUTLIER -74.5 146.33 42.81 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 179.19 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 41.6 t -99.48 126.07 52.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.03 0.443 . . . . 10.0 111.186 -179.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.7 tt -135.36 143.01 38.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.971 -0.559 . . . . 10.0 109.683 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -110.47 153.62 24.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.018 0.437 . . . . 10.0 110.848 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.9 p -132.42 129.61 59.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.624 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -125.32 165.21 18.77 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.474 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -91.03 132.92 35.71 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.293 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.522 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.9 mm-40 -77.17 152.82 34.66 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.85 0.357 . . . . 10.0 110.807 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -77.64 -14.43 59.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.301 0.572 . . . . 10.0 110.024 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.6 p -71.36 -43.73 66.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.53 -0.759 . . . . 10.0 110.706 179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 102.9 -16.21 54.62 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.989 -0.625 . . . . 10.0 112.324 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.933 0 CA-C-O 118.897 -0.946 . . . . 10.0 111.337 -179.617 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 . . . . . 0 N--CA 1.484 1.225 0 CA-C-O 121.044 0.45 . . . . 10.0 110.837 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -120.29 123.13 42.4 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.509 -0.923 . . . . 10.0 108.509 178.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . 0.491 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 27.4 ptt180 -126.25 127.86 46.28 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 119.904 -0.718 . . . . 10.0 111.922 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . 0.456 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 34.5 t70 -120.87 130.59 24.78 Favored Pre-proline 0 C--N 1.317 -0.819 0 N-CA-C 106.276 -1.749 . . . . 10.0 106.276 177.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 61.2 Cg_endo -108.05 129.22 0.05 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.281 0 C-N-CA 121.589 1.526 . . . . 10.0 114.005 -177.671 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 23.6 mt -119.08 132.09 69.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 CA-C-N 114.32 -1.309 . . . . 10.0 109.971 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 10.5 t -117.28 135.97 55.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 109.495 -0.557 . . . . 10.0 109.495 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . 0.421 HD12 ' HA ' ' B' ' 364' ' ' ILE . 5.4 tp -112.71 146.65 17.16 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 CA-C-N 114.93 -1.032 . . . . 10.0 110.945 -177.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -110.44 130.23 55.6 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.281 -0.872 . . . . 10.0 111.636 -174.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . 0.462 ' P ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo . . . . . 0 C--O 1.252 1.182 0 C-N-CA 122.509 2.139 . . . . 10.0 111.477 178.798 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 . . . . . 0 N--CA 1.482 1.167 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.4 mm -107.6 110.12 30.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.89 0.376 . . . . 10.0 110.089 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.423 ' NZ ' ' HB3' ' A' ' 23' ' ' LYS . 1.7 ttpm? -100.05 100.45 11.33 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.159 0.504 . . . . 10.0 110.513 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 33.3 mt -83.27 152.22 25.25 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.101 -179.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 40.4 mtpt -110.11 108.85 19.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.06 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.413 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.1 t -90.39 131.07 38.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.274 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.4 mm -89.98 110.83 22.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.464 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -76.14 152.9 42.57 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.846 -0.615 . . . . 10.0 112.172 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -61.88 -22.51 65.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.834 0.349 . . . . 10.0 111.553 -179.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -97.29 20.82 10.88 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.841 0.353 . . . . 10.0 110.569 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.2 m 67.42 44.94 1.67 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.605 -0.725 . . . . 10.0 111.128 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.8 p -107.3 149.74 27.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.634 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 10.0 mt-10 -107.5 101.95 11.26 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.761 -0.459 . . . . 10.0 109.761 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.41 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 5.6 mm -92.21 125.94 44.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.269 -179.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 23.5 m-70 -102.01 101.96 12.41 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.747 -0.464 . . . . 10.0 109.747 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.73 113.98 26.3 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.458 -179.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -85.7 99.51 11.36 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.867 -0.42 . . . . 10.0 109.867 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 m -106.13 168.88 2.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.996 -179.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.46 ' HE2' ' OG1' ' A' ' 41' ' ' THR . 79.1 tttt -120.0 143.2 48.18 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.855 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 58.9 tpp -76.74 58.56 1.44 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.347 0.594 . . . . 10.0 110.507 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.46 ' OG1' ' HE2' ' A' ' 39' ' ' LYS . 5.7 m -158.07 -42.11 0.06 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.513 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.3 147.94 37.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.837 -0.619 . . . . 10.0 111.251 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.462 ' HA ' HG22 ' A' ' 76' ' ' THR . 7.3 m80 -75.92 151.98 37.2 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.585 ' HA ' HD23 ' A' ' 47' ' ' LEU . 12.6 mt -66.33 -12.45 56.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.753 0.311 . . . . 10.0 111.36 -179.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 43.4 tptt -59.12 -44.4 92.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.156 0.503 . . . . 10.0 109.67 178.129 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -64.69 -32.72 74.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.204 -0.907 . . . . 10.0 110.655 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.585 HD23 ' HA ' ' A' ' 44' ' ' LEU . 2.5 mm? -74.96 -41.78 58.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.965 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -60.64 -47.71 85.04 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.898 -179.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -67.31 -46.73 72.65 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.946 0.35 . . . . 10.0 111.946 -178.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.7 m -61.09 -36.38 79.51 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.724 0.268 . . . . 10.0 111.724 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -64.65 -45.84 85.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.774 0.321 . . . . 10.0 110.465 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 60.3 m -59.93 -49.23 78.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.659 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -58.37 -39.88 80.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.128 0.489 . . . . 10.0 110.789 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -64.53 -39.58 94.03 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.154 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -80.3 -6.07 57.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.284 -0.416 . . . . 10.0 111.809 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.91 37.95 17.48 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.654 -0.784 . . . . 10.0 112.694 179.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -139.65 150.72 64.22 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 110.028 -0.36 . . . . 10.0 110.028 179.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.06 162.15 34.76 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.163 1.909 . . . . 10.0 111.424 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.495 ' HG3' ' N ' ' A' ' 60' ' ' ASN . 0.9 OUTLIER -62.84 147.83 48.91 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.893 -0.14 . . . . 10.0 110.637 179.431 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.495 ' N ' ' HG3' ' A' ' 59' ' ' MET . 35.7 t30 83.62 6.11 0.73 Allowed 'General case' 0 N--CA 1.475 0.823 0 O-C-N 124.069 0.856 . . . . 10.0 112.012 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 57.6 p -90.1 -33.88 16.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.041 0.448 . . . . 10.0 110.294 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 92' ' ' GLN . 33.6 mt -115.2 146.46 41.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.675 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.524 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 15.0 ptt-85 -117.02 135.64 53.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.217 179.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -93.98 127.23 39.64 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.169 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.0 mt -109.86 124.15 50.83 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.552 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -138.04 121.69 17.43 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.385 -0.825 . . . . 10.0 109.208 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 61.91 24.97 14.95 Favored 'General case' 0 C--N 1.331 -0.221 0 O-C-N 123.483 0.49 . . . . 10.0 110.989 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.63 2.0 87.2 Favored Glycine 0 CA--C 1.522 0.474 0 C-N-CA 121.115 -0.564 . . . . 10.0 113.07 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -114.19 164.93 13.21 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.945 0.372 . . . . 10.0 110.572 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -100.3 130.26 46.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.015 0.435 . . . . 10.0 110.217 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.9 mm -67.57 124.44 22.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.736 -0.665 . . . . 10.0 111.383 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -85.08 172.76 11.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.304 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 2.6 m-20 -80.88 -15.45 56.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.883 0.373 . . . . 10.0 111.205 -179.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -107.49 30.18 6.5 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.219 0.533 . . . . 10.0 110.577 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.412 ' HB3' HD12 ' A' ' 44' ' ' LEU . 2.6 m170 -104.47 152.62 22.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.972 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.462 HG22 ' HA ' ' A' ' 43' ' ' HIS . 6.1 p -130.1 153.81 81.17 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.966 178.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -62.88 -13.78 36.85 Favored 'Trans proline' 0 N--CA 1.475 0.414 0 C-N-CA 122.701 2.267 . . . . 10.0 112.865 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -72.35 -34.36 67.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.839 -179.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 76' ' ' THR . 6.0 pt-20 -94.72 174.34 7.16 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.935 -0.395 . . . . 10.0 109.935 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 15.9 mt 73.84 -41.38 0.48 Allowed 'General case' 0 N--CA 1.468 0.431 0 O-C-N 123.684 0.615 . . . . 10.0 111.249 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 107.79 56.32 0.6 Allowed Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.883 -0.675 . . . . 10.0 112.341 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 47.5 mtt -90.5 128.91 36.68 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.097 -0.334 . . . . 10.0 110.097 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.508 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.3 mm-40 -126.56 -179.91 5.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.089 0.471 . . . . 10.0 111.635 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -68.07 140.02 56.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.645 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 62.01 23.61 13.94 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.024 -0.535 . . . . 10.0 111.709 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.508 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.7 t0 -70.75 148.88 47.48 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.204 -0.198 . . . . 10.0 110.548 179.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 89.7 t -97.61 114.02 33.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.036 0.446 . . . . 10.0 111.59 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.413 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 18.8 tt -119.61 142.48 34.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -110.83 151.94 27.24 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.029 0.443 . . . . 10.0 111.636 -178.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.2 p -136.25 125.54 38.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.64 179.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -131.8 157.24 44.39 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.409 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.422 ' HA ' HD23 ' A' ' 62' ' ' LEU . 6.2 tt0 -75.97 138.89 41.24 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.904 0.383 . . . . 10.0 110.845 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.524 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.2 mm-40 -81.05 147.84 29.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.714 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -70.72 -15.4 62.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.08 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.31 -16.72 58.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.962 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.12 -47.3 3.55 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.963 -0.637 . . . . 10.0 112.352 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.821 0 N-CA-C 110.612 -0.995 . . . . 10.0 110.612 179.993 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 . . . . . 0 N--CA 1.477 0.9 0 CA-C-O 121.244 0.545 . . . . 10.0 109.912 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . 0.437 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 53.4 t-20 -121.7 123.86 42.87 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.192 -1.04 . . . . 10.0 108.192 179.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -123.12 122.72 39.15 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.414 -0.914 . . . . 10.0 112.811 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . 0.417 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 18.5 t70 -128.82 128.39 23.46 Favored Pre-proline 0 C--N 1.319 -0.755 0 N-CA-C 107.398 -1.334 . . . . 10.0 107.398 174.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 54.0 Cg_endo -111.72 128.44 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.141 0 C-N-CA 121.551 1.501 . . . . 10.0 113.789 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 5.1 mt -117.48 135.61 57.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.06 -0.973 . . . . 10.0 109.311 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 19.6 t -113.99 133.51 59.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.569 0.699 . . . . 10.0 110.626 -178.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 4.7 tp -116.27 143.05 27.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 114.985 -1.007 . . . . 10.0 111.014 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -110.09 128.6 55.53 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.506 0.669 . . . . 10.0 111.381 -175.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo . . . . . 0 C--O 1.248 1.012 0 C-N-CA 123.424 2.75 . . . . 10.0 112.749 179.719 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 . . . . . 0 N--CA 1.479 1.019 0 N-CA-C 110.246 -0.279 . . . . 10.0 110.246 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.1 mm -118.52 117.41 54.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.535 ' HZ2' ' CD ' ' A' ' 84' ' ' GLU . 0.0 OUTLIER -97.93 108.75 21.52 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.92 0.391 . . . . 10.0 110.855 -179.816 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 66.7 mt -94.26 126.85 39.76 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.966 -0.561 . . . . 10.0 109.909 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 34' ' ' ILE . 33.4 mtpt -96.84 109.7 22.34 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.01 0.433 . . . . 10.0 110.721 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.4 t -91.98 123.71 44.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.63 -0.713 . . . . 10.0 109.665 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.6 mm -94.06 113.22 28.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 120.984 0.421 . . . . 10.0 110.852 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.6 156.3 33.14 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.81 -0.632 . . . . 10.0 112.087 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -70.15 -12.4 61.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.875 0.369 . . . . 10.0 111.362 -179.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -100.69 22.43 11.94 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.35 0.595 . . . . 10.0 110.052 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.2 m 63.71 45.33 4.58 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 114.814 -1.085 . . . . 10.0 111.822 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.2 p -111.58 138.34 48.24 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.206 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.495 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 16.6 mt-10 -108.81 103.94 13.11 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.152 0.501 . . . . 10.0 109.942 179.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.475 ' O ' ' HA ' ' A' ' 25' ' ' LYS . 3.9 mm -91.18 129.91 41.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.443 -179.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.456 ' CD2' ' HB3' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -109.36 101.28 10.28 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.437 -0.347 . . . . 10.0 110.067 -179.696 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.23 115.35 27.3 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.2 -0.296 . . . . 10.0 110.2 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -88.06 100.13 12.7 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.469 HG12 HD11 ' A' ' 47' ' ' LEU . 3.0 m -107.45 174.04 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.996 0.427 . . . . 10.0 111.544 -178.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.3 tttt -123.23 146.7 47.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.817 -0.629 . . . . 10.0 109.493 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.496 ' O ' ' HB ' ' A' ' 41' ' ' THR . 49.0 tpp -77.64 76.02 4.18 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.089 0.471 . . . . 10.0 111.569 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.496 ' HB ' ' O ' ' A' ' 40' ' ' MET . 15.3 t 170.12 -25.83 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.466 -0.788 . . . . 10.0 110.0 178.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.419 ' OG1' ' HB2' ' B' ' 366' ' ' ASP . 0.9 OUTLIER -74.49 134.01 42.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.239 179.336 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 31.5 m170 -70.11 143.78 52.27 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.575 -179.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 75.2 mt -69.38 -8.59 47.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 10.0 111.042 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.511 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 37.4 tptt -58.18 -53.99 52.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.527 178.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -61.16 -41.74 97.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.525 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.469 HD11 HG12 ' A' ' 38' ' ' VAL . 3.4 mm? -57.97 -41.79 83.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.609 -179.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -68.67 -31.98 71.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.403 -0.362 . . . . 10.0 111.315 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.511 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 39.7 mt-10 -75.32 -51.78 12.39 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.751 0.31 . . . . 10.0 111.306 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.0 m -61.33 -33.77 74.16 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.278 0.473 . . . . 10.0 112.278 -179.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -63.14 -46.06 89.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.706 0.288 . . . . 10.0 110.778 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.504 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 58.8 m -61.95 -37.23 83.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.093 0.473 . . . . 10.0 110.245 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -61.71 -42.84 99.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.764 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 52.9 ttt85 -69.22 -33.41 73.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.375 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -74.78 -16.42 60.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.708 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.88 30.92 45.66 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.911 -0.661 . . . . 10.0 112.84 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.8 m -137.49 154.53 75.27 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 110.205 -0.295 . . . . 10.0 110.205 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.51 154.64 58.02 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.443 2.095 . . . . 10.0 111.829 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.504 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 3.9 ttt -66.54 157.22 32.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.725 -0.216 . . . . 10.0 110.98 -179.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.446 ' N ' ' HG2' ' A' ' 59' ' ' MET . 4.3 t30 78.02 4.17 2.84 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.633 0.773 . . . . 10.0 111.571 179.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 59.4 p -87.88 -19.98 26.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.076 0.465 . . . . 10.0 109.958 179.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.0 mt -125.77 135.22 51.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.665 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.509 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 29.1 ptt-85 -112.09 138.96 48.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.241 -0.436 . . . . 10.0 109.88 179.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -96.19 132.03 42.04 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.9 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.0 mt -115.78 115.69 26.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.005 0.431 . . . . 10.0 111.132 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -128.07 118.57 23.71 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.563 -0.744 . . . . 10.0 109.357 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 61.66 29.97 18.35 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.079 0.466 . . . . 10.0 110.752 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.89 -4.28 75.84 Favored Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.862 -0.608 . . . . 10.0 112.604 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 44.8 mm-40 -102.34 136.79 41.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.576 0.226 . . . . 10.0 110.717 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -82.3 128.71 34.47 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.621 -0.511 . . . . 10.0 109.621 178.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 46.6 mm -70.03 118.84 15.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.229 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -90.11 168.78 11.7 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.295 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.91 -24.83 62.54 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.202 0.525 . . . . 10.0 110.579 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -95.77 24.97 4.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.423 -0.808 . . . . 10.0 111.58 -179.045 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 50.1 m170 -109.32 157.47 18.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.79 0.328 . . . . 10.0 110.837 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.586 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 27.9 p -134.26 160.31 68.97 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.067 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -68.73 -14.22 38.7 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.364 2.042 . . . . 10.0 112.012 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -69.65 -34.11 73.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.882 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.586 ' HG2' ' O ' ' A' ' 76' ' ' THR . 6.3 pt-20 -91.22 168.8 11.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.063 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 17.8 mt 73.01 -48.81 0.69 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.405 0.682 . . . . 10.0 111.432 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.14 58.89 0.33 Allowed Glycine 0 N--CA 1.444 -0.77 0 C-N-CA 120.652 -0.785 . . . . 10.0 112.558 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 43.6 mtt -86.34 120.21 27.44 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 179.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -113.17 178.14 4.38 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.204 0.525 . . . . 10.0 111.534 -178.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.535 ' CD ' ' HZ2' ' A' ' 23' ' ' LYS . 3.6 tp10 -69.01 140.52 54.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.413 -0.812 . . . . 10.0 110.762 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 63.6 mm-40 60.59 32.84 20.46 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.792 -0.64 . . . . 10.0 111.582 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -80.61 146.44 31.2 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.663 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 20.2 t -98.11 132.1 43.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.763 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.437 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 20.3 tt -135.42 149.34 28.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.018 179.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -108.95 152.49 24.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.982 0.42 . . . . 10.0 111.382 -179.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.8 p -135.22 135.86 51.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.469 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -137.37 157.22 47.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.716 -0.22 . . . . 10.0 110.791 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -80.61 131.36 35.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.581 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.509 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.6 mm-40 -69.47 145.28 52.86 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.879 -179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -63.21 -23.13 67.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.07 -0.514 . . . . 10.0 111.441 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.0 p -76.74 -20.39 56.57 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.908 0.385 . . . . 10.0 111.219 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.67 -11.18 62.42 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 121.005 -0.617 . . . . 10.0 111.948 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.786 -1.008 . . . . 10.0 111.275 -179.808 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 55.9 t30 . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.775 0.322 . . . . 10.0 110.77 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . 0.495 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 59.7 t30 -120.24 124.38 45.53 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 109.364 -0.606 . . . . 10.0 109.364 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 24.5 ptt180 -124.2 128.24 48.92 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.42 0.629 . . . . 10.0 111.321 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -120.66 130.33 24.9 Favored Pre-proline 0 C--N 1.318 -0.791 0 N-CA-C 107.569 -1.271 . . . . 10.0 107.569 177.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -108.79 130.59 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.232 0 C-N-CA 121.948 1.765 . . . . 10.0 113.456 -178.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 2.6 mt -117.67 136.44 54.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 113.967 -1.47 . . . . 10.0 109.705 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 60.3 t -113.42 133.01 60.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 N-CA-C 109.109 -0.7 . . . . 10.0 109.109 -179.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . . . . . . . . . 6.3 tp -114.98 144.23 22.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-N 114.628 -1.169 . . . . 10.0 110.948 -176.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . 0.419 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 2.0 t70 -110.71 130.11 55.66 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.287 -0.87 . . . . 10.0 112.093 -173.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo . . . . . 0 C--O 1.251 1.152 0 C-N-CA 122.46 2.107 . . . . 10.0 111.488 178.648 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 . . . . . 0 N--CA 1.477 0.881 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 11.6 mm -112.79 123.28 68.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.432 -0.581 . . . . 10.0 109.432 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.7 ttpm? -100.18 113.7 26.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.953 0.406 . . . . 10.0 111.207 -179.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 80.3 mt -101.26 140.07 36.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.803 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.0 mtpt -101.77 110.44 22.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.758 0.313 . . . . 10.0 110.766 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.46 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 7.1 t -88.1 123.48 40.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 108.915 -0.772 . . . . 10.0 108.915 178.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.8 mm -92.82 111.95 25.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 120.956 0.408 . . . . 10.0 111.473 -178.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.26 156.8 29.85 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 111.314 -0.715 . . . . 10.0 111.314 178.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 48.2 tp60 -64.88 -22.18 66.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.886 0.374 . . . . 10.0 110.992 -179.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -93.98 17.52 12.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.962 0.41 . . . . 10.0 110.819 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.2 m 62.98 45.8 5.16 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.721 -0.672 . . . . 10.0 111.415 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.3 128.74 38.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.959 179.2 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.456 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 3.6 mp0 -92.34 88.06 6.28 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.513 0.673 . . . . 10.0 110.255 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.46 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 12.7 mm -80.97 128.63 38.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.617 -0.72 . . . . 10.0 111.929 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.4 ' O ' ' HA ' ' B' ' 361' ' ' PRO . 10.1 m170 -103.7 89.82 3.46 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.143 -0.688 . . . . 10.0 109.143 178.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -92.61 109.54 20.96 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.774 -0.371 . . . . 10.0 110.86 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -88.48 97.28 10.99 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.552 -0.536 . . . . 10.0 109.552 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.4 m -98.34 168.15 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.885 -179.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 54.1 tttt -118.43 135.33 54.42 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.261 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 45.3 tpp -80.26 77.46 7.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.088 0.471 . . . . 10.0 110.885 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.8 t 177.95 -37.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.707 -0.679 . . . . 10.0 110.222 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.7 148.79 28.8 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.142 179.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 13.5 m80 -68.9 153.46 43.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.597 0.237 . . . . 10.0 110.743 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.436 HD12 ' HB3' ' A' ' 75' ' ' HIS . 34.7 mt -69.31 -15.86 63.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.506 -0.315 . . . . 10.0 111.136 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 36.2 tttp -59.25 -46.67 87.88 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.928 -0.397 . . . . 10.0 109.928 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.53 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.5 tppp? -58.7 -32.04 68.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.559 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -74.62 -39.33 62.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.626 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -62.86 -52.5 62.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.899 -0.592 . . . . 10.0 111.789 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.404 ' HG2' ' H ' ' A' ' 49' ' ' GLU . 3.1 pt-20 -64.4 -31.74 73.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.582 -0.281 . . . . 10.0 111.461 -179.03 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 53.9 m -72.92 -34.95 66.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.754 0.311 . . . . 10.0 110.918 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -65.98 -36.06 82.29 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.933 0.397 . . . . 10.0 110.14 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 56.6 m -61.95 -40.27 94.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.947 -0.569 . . . . 10.0 109.782 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -66.45 -31.94 73.0 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.54 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.418 HH21 ' CG ' ' B' ' 360' ' ' ASP . 16.9 tpt180 -68.48 -39.74 81.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.871 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -85.51 -16.71 38.65 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.476 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.63 37.93 13.02 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.817 -0.706 . . . . 10.0 112.398 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 9.1 m -133.61 155.41 80.57 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 110.224 -0.288 . . . . 10.0 110.224 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -70.03 167.69 24.07 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.251 1.967 . . . . 10.0 111.373 179.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.7 ttt -74.19 163.52 27.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.608 0.242 . . . . 10.0 110.572 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.2 t30 74.74 0.58 3.6 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.367 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.3 p -86.56 -46.87 9.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.124 0.488 . . . . 10.0 110.036 179.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.2 mt -99.55 131.02 45.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.866 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.528 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 13.2 ptt180 -110.3 128.71 55.67 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.79 179.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -88.5 130.27 35.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.937 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.7 mt -113.81 126.22 54.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.067 0.46 . . . . 10.0 110.397 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -135.62 117.32 15.01 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.624 -0.716 . . . . 10.0 109.926 -179.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 62.74 18.51 10.71 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.761 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.91 -18.73 49.0 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.604 -0.808 . . . . 10.0 112.911 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -98.31 157.77 15.98 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.621 -0.34 . . . . 10.0 110.639 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -96.2 131.26 42.85 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.339 -0.391 . . . . 10.0 110.308 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 48.8 mm -66.68 121.03 15.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.609 -0.723 . . . . 10.0 111.556 -179.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.95 168.26 13.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.52 -0.764 . . . . 10.0 110.57 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -75.67 -18.5 59.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.217 0.532 . . . . 10.0 110.479 179.759 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -96.29 11.44 34.59 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.946 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.436 ' HB3' HD12 ' A' ' 44' ' ' LEU . 2.5 m170 -90.01 145.7 24.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.235 0.541 . . . . 10.0 111.558 -179.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 34.9 p -118.07 155.24 51.52 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.539 -0.755 . . . . 10.0 109.172 178.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_exo -68.96 -7.55 21.09 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.518 2.146 . . . . 10.0 112.805 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -86.51 -33.5 20.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.42 -0.354 . . . . 10.0 111.235 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 11.2 pt-20 -85.48 174.91 9.15 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.619 -0.432 . . . . 10.0 110.006 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.42 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 87.6 mt 73.04 -59.46 0.57 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.318 0.647 . . . . 10.0 110.701 -179.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 132.07 61.63 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.592 -0.813 . . . . 10.0 113.033 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 49.5 mtt -98.42 133.59 42.59 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.354 -0.239 . . . . 10.0 110.354 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.2 mm-40 -132.62 -176.96 4.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.183 0.516 . . . . 10.0 111.436 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -70.06 140.1 52.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.154 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 63.95 27.62 14.38 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 123.526 0.516 . . . . 10.0 111.231 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -74.07 171.12 14.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.04 0.448 . . . . 10.0 111.397 -179.432 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.5 t -121.12 132.73 69.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.898 -178.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 20.5 tt -138.89 140.88 37.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 110.165 -0.309 . . . . 10.0 110.165 179.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -103.35 156.17 17.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.699 -179.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.4 p -143.27 127.27 14.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.112 0.482 . . . . 10.0 110.219 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -136.66 165.23 26.38 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.971 -0.558 . . . . 10.0 110.039 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -90.38 136.81 32.82 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 110.353 -0.239 . . . . 10.0 110.353 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.528 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.1 mm-40 -67.66 164.94 18.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.709 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -68.64 -26.94 65.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.082 -179.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 34.1 p -74.7 -30.86 61.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.36 0.6 . . . . 10.0 110.769 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.98 20.4 67.89 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.208 -0.757 . . . . 10.0 111.208 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.671 -1.072 . . . . 10.0 111.302 -179.596 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 64.2 t30 . . . . . 0 N--CA 1.482 1.153 0 CA-C-O 121.364 0.602 . . . . 10.0 110.492 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 42.5 t30 -119.15 123.09 43.53 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.265 -1.013 . . . . 10.0 108.265 179.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . 0.456 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 13.5 ptt180 -124.14 125.4 44.41 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 120.156 -0.617 . . . . 10.0 111.053 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . 0.418 ' CG ' HH21 ' A' ' 54' ' ' ARG . 30.9 t0 -124.13 130.18 24.47 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 107.544 -1.28 . . . . 10.0 107.544 176.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . 0.4 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 53.0 Cg_endo -108.18 129.51 0.05 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.516 0 C-N-CA 121.969 1.779 . . . . 10.0 111.848 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 10.6 mt -117.35 136.75 53.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 114.695 -1.139 . . . . 10.0 110.276 -178.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 11.4 t -112.17 135.69 50.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.984 -178.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . 0.53 HD11 ' HG3' ' A' ' 46' ' ' LYS . 8.7 tp -113.05 145.19 19.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 114.878 -1.055 . . . . 10.0 111.439 -176.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -114.77 130.81 56.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.847 -1.07 . . . . 10.0 111.94 -175.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo . . . . . 0 C--O 1.244 0.819 0 C-N-CA 123.094 2.529 . . . . 10.0 112.375 -179.718 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 . . . . . 0 N--CA 1.477 0.905 0 N-CA-C 110.162 -0.31 . . . . 10.0 110.162 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.4 mm -109.68 119.17 58.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 109.408 -0.59 . . . . 10.0 109.408 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.437 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 6.8 ttpm? -96.28 108.65 21.17 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.19 0.519 . . . . 10.0 110.835 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.8 mt -98.3 136.58 38.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.573 179.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 78.3 mttt -97.56 112.84 24.54 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.138 0.494 . . . . 10.0 110.596 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.404 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.8 t -91.95 135.24 27.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.153 -179.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 32.6 mm -90.72 108.39 19.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.619 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.425 ' HA3' ' OG ' ' A' ' 32' ' ' SER . . . -80.71 150.33 31.03 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.809 -0.71 . . . . 10.0 112.043 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -64.08 -22.67 67.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.846 0.355 . . . . 10.0 111.516 -179.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.8 p-10 -96.49 26.73 4.21 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.717 0.294 . . . . 10.0 110.92 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 29.5 m 60.63 45.06 10.76 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.502 0.667 . . . . 10.0 110.864 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.425 ' OG ' ' HA3' ' A' ' 28' ' ' GLY . 3.8 p -106.65 149.48 27.19 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.395 -0.821 . . . . 10.0 110.608 -179.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.509 ' O ' ' HA ' ' B' ' 359' ' ' ARG . 28.1 tt0 -108.73 97.34 7.0 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.228 -0.656 . . . . 10.0 109.228 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.404 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 0.8 OUTLIER -86.23 126.24 40.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.658 -178.928 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.8 m170 -101.99 96.79 7.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.114 0.483 . . . . 10.0 109.946 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -89.32 109.98 20.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.923 -0.581 . . . . 10.0 110.425 -179.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -89.72 91.56 8.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.321 179.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.415 ' HA ' ' CG2' ' B' ' 364' ' ' ILE . 5.1 m -100.93 -174.54 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.761 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -135.11 143.85 46.83 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.955 -0.387 . . . . 10.0 109.955 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 60.8 tpp -78.42 60.83 2.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.408 0.623 . . . . 10.0 110.555 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.2 m -161.69 -38.76 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.605 -0.725 . . . . 10.0 109.597 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.59 153.61 38.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.482 -0.781 . . . . 10.0 111.628 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -80.07 151.48 29.86 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.387 -0.824 . . . . 10.0 110.019 179.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.494 ' HA ' HD23 ' A' ' 47' ' ' LEU . 74.7 mt -72.07 -10.63 60.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.743 0.306 . . . . 10.0 110.758 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -59.91 -46.68 88.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.981 178.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.485 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.9 tppp? -62.99 -41.0 99.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.411 -0.813 . . . . 10.0 110.778 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.494 HD23 ' HA ' ' A' ' 44' ' ' LEU . 1.5 mm? -65.07 -41.58 94.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.915 -178.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -58.79 -47.56 84.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.285 -0.416 . . . . 10.0 112.015 -179.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -74.39 -38.22 63.18 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.717 -0.393 . . . . 10.0 111.674 -179.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 63.5 m -59.56 -34.01 72.14 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.888 0.375 . . . . 10.0 110.744 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -69.78 -41.66 74.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.332 -0.395 . . . . 10.0 109.937 178.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.563 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 79.4 m -62.1 -43.38 98.95 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.327 -0.397 . . . . 10.0 109.939 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -63.37 -36.38 83.53 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.215 0.531 . . . . 10.0 110.175 179.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -65.32 -40.33 93.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.404 179.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -77.68 -22.73 50.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.07 -0.513 . . . . 10.0 110.949 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 89.43 24.96 29.56 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.326 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.5 m -124.07 154.43 68.13 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 110.394 -0.225 . . . . 10.0 110.394 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -61.18 153.05 67.65 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.473 2.116 . . . . 10.0 111.608 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.563 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 17.2 ttt -65.82 152.38 44.51 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 121.232 -0.187 . . . . 10.0 110.889 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.5 t30 82.53 -3.78 1.38 Allowed 'General case' 0 N--CA 1.472 0.644 0 O-C-N 124.175 0.922 . . . . 10.0 111.681 179.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.4 p -79.0 -24.35 43.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.202 0.525 . . . . 10.0 110.326 179.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.1 mt -117.82 131.48 56.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.124 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.432 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 16.6 ptt-85 -104.1 138.27 40.84 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.322 179.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.415 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 73.4 m-85 -100.41 127.26 46.78 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.139 -0.482 . . . . 10.0 109.924 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt -112.17 117.09 31.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.048 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -117.52 107.19 13.98 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.71 -0.677 . . . . 10.0 109.291 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 59.1 34.29 23.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.092 0.472 . . . . 10.0 111.02 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.61 -3.11 87.31 Favored Glycine 0 CA--C 1.518 0.262 0 CA-C-N 115.849 -0.614 . . . . 10.0 113.103 179.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -106.7 128.51 54.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.871 0.336 . . . . 10.0 110.494 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.415 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 13.9 ptm180 -76.25 126.66 31.39 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.074 0.464 . . . . 10.0 110.532 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 47.4 mm -66.78 123.6 20.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.577 -0.738 . . . . 10.0 110.953 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -84.74 170.9 12.79 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.674 -0.693 . . . . 10.0 110.787 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.48 5.54 17.46 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.96 -0.564 . . . . 10.0 111.147 -179.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -130.32 18.16 5.41 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.708 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.483 ' HB3' HD12 ' A' ' 44' ' ' LEU . 22.3 m170 -88.94 159.46 17.64 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.07 0.462 . . . . 10.0 111.114 -179.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.488 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -131.34 153.47 81.65 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.595 -0.729 . . . . 10.0 110.075 179.678 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.2 -17.82 55.08 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.393 2.062 . . . . 10.0 112.325 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -70.68 -36.67 73.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.925 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 76' ' ' THR . 11.2 pt-20 -85.87 167.23 15.34 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.604 -0.517 . . . . 10.0 109.604 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.432 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 84.9 mt 73.79 -51.36 0.69 Allowed 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.208 0.603 . . . . 10.0 110.63 -179.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 117.02 61.41 0.31 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.006 -0.616 . . . . 10.0 113.022 178.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 44.4 mtt -87.32 125.05 33.99 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.759 0.314 . . . . 10.0 110.311 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.508 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 7.4 mm-40 -123.74 177.6 5.63 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.135 0.493 . . . . 10.0 111.336 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.437 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 21.7 tp10 -70.25 142.09 52.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.706 179.407 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.436 ' HG2' ' HG3' ' A' ' 84' ' ' GLU . 70.2 mm-40 68.23 25.06 7.31 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 123.464 0.477 . . . . 10.0 111.039 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.508 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.1 t70 -76.52 162.16 28.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.523 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 95.4 t -117.17 125.52 73.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.869 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.4 tt -129.4 137.55 56.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.061 -0.518 . . . . 10.0 109.959 179.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -103.49 149.56 24.73 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.898 0.38 . . . . 10.0 111.536 -178.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -132.06 130.89 61.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.835 -0.621 . . . . 10.0 109.808 179.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -134.77 157.62 46.28 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.761 0.315 . . . . 10.0 111.138 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -75.4 129.73 37.82 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.679 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.432 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 3.1 mm-40 -79.15 152.65 30.6 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.742 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -77.05 0.15 22.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.707 -0.679 . . . . 10.0 111.433 -178.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.4 p -88.31 -27.86 21.42 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.086 0.469 . . . . 10.0 110.525 179.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.09 16.3 80.66 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.818 -0.628 . . . . 10.0 111.674 -179.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.945 -0.919 . . . . 10.0 110.965 -179.589 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 29.6 t30 . . . . . 0 N--CA 1.483 1.177 0 CA-C-O 120.458 0.171 . . . . 10.0 110.886 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -120.19 119.83 34.37 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 119.703 -0.799 . . . . 10.0 109.451 178.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . 0.509 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 18.4 ptt180 -130.01 129.76 44.12 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.377 0.51 . . . . 10.0 112.377 179.06 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . 0.41 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 23.8 t70 -121.85 129.96 24.94 Favored Pre-proline 0 C--N 1.316 -0.867 0 N-CA-C 107.31 -1.367 . . . . 10.0 107.31 175.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 71.7 Cg_endo -108.37 129.11 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.107 0 C-N-CA 121.651 1.567 . . . . 10.0 112.581 -179.072 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 7.4 mt -117.84 136.36 55.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 114.182 -1.372 . . . . 10.0 110.735 -177.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 99.3 t -114.28 135.2 54.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 108.509 -0.923 . . . . 10.0 108.509 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . 0.485 HD11 ' HG3' ' A' ' 46' ' ' LYS . 8.3 tp -114.16 147.22 17.81 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 114.818 -1.083 . . . . 10.0 112.261 -176.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -114.46 129.95 56.69 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.927 -1.033 . . . . 10.0 111.211 -175.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . 0.45 ' HA ' ' HD3' ' B' ' 368' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' B' ' 367' ' ' SEP . 21.8 Cg_exo . . . . . 0 C--O 1.246 0.882 0 C-N-CA 123.142 2.562 . . . . 10.0 111.516 179.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 N--CA 1.481 1.08 0 CA-C-O 120.84 0.353 . . . . 10.0 110.624 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.8 mm -122.44 117.05 50.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 179.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.56 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 1.9 ttpm? -93.15 119.49 32.41 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.132 0.491 . . . . 10.0 111.021 -179.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 59.2 mt -102.27 142.38 33.59 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.762 -0.654 . . . . 10.0 110.096 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.3 mtpt -100.12 100.91 11.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.958 0.409 . . . . 10.0 110.481 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.598 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.3 t -86.17 118.01 31.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.8 mm -97.18 112.65 29.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.025 0.441 . . . . 10.0 111.511 -178.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.26 160.09 37.89 Favored Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 110.901 -0.88 . . . . 10.0 110.901 178.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -66.74 -19.35 65.73 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.911 0.355 . . . . 10.0 111.354 -179.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.39 27.65 3.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.52 -0.309 . . . . 10.0 111.047 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.0 m 62.28 33.79 16.35 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.51 179.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.58 110.14 22.27 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.459 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.4 ' OE1' ' N ' ' B' ' 357' ' ' ASN . 8.7 mt-10 -91.79 98.94 11.92 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.252 -0.647 . . . . 10.0 109.252 178.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.408 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 5.1 mm -87.04 127.82 40.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.467 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.446 ' ND1' ' HE3' ' A' ' 23' ' ' LYS . 14.7 m-70 -103.46 85.66 2.51 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -89.92 119.12 30.02 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.566 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -90.91 101.41 14.17 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.136 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 m -97.57 172.1 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.777 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.442 ' HD3' ' CB ' ' B' ' 366' ' ' ASP . 77.9 tttt -123.51 141.31 52.13 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.819 -0.437 . . . . 10.0 109.819 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.499 ' SD ' ' HB2' ' A' ' 77' ' ' PRO . 41.4 tpp -78.26 54.23 1.35 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.078 0.466 . . . . 10.0 111.548 -179.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 52.7 m -154.64 -45.15 0.09 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.221 179.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.443 ' OG1' ' HB2' ' B' ' 366' ' ' ASP . 0.3 OUTLIER -73.32 153.05 40.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.693 179.85 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -79.25 155.82 28.38 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.005 -0.739 . . . . 10.0 109.005 179.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 78.3 mt -69.81 -8.22 46.42 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.78 0.324 . . . . 10.0 111.172 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 47.8 tptt -58.98 -49.47 77.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.989 -0.551 . . . . 10.0 109.98 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.48 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.9 tppp? -59.64 -41.55 90.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.34 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.46 -40.22 95.28 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.418 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -63.95 -45.31 89.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.321 -0.4 . . . . 10.0 112.053 -179.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -73.7 -39.29 64.46 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.668 -0.413 . . . . 10.0 111.536 -179.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.476 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 67.6 m -64.92 -32.47 74.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.825 0.345 . . . . 10.0 111.09 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -65.62 -38.46 89.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.057 0.456 . . . . 10.0 110.391 179.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.507 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 60.2 m -63.01 -36.07 82.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.714 -0.676 . . . . 10.0 110.138 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.476 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 74.2 mt-30 -67.91 -34.18 76.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.802 -0.635 . . . . 10.0 110.515 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -67.43 -38.44 84.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.578 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -80.89 -34.48 33.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.309 -179.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 99.97 37.13 3.98 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.69 -0.767 . . . . 10.0 112.168 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.448 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 2.5 m -137.1 155.82 75.89 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 109.984 -0.376 . . . . 10.0 109.984 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -69.17 155.19 68.65 Favored 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.18 1.92 . . . . 10.0 111.382 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.507 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 11.9 ttt -64.09 158.02 23.87 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 121.097 -0.241 . . . . 10.0 111.176 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.6 t30 81.03 -0.48 1.76 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.75 0.82 . . . . 10.0 111.461 179.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 57.1 p -86.25 -29.5 23.06 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.17 0.509 . . . . 10.0 110.441 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 25.0 mt -119.06 140.47 50.01 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.795 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.479 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 21.4 ptt-85 -117.44 141.59 48.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.159 179.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.467 ' HB3' HD11 ' A' ' 88' ' ' ILE . 93.4 m-85 -96.83 129.72 44.22 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.138 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.1 mt -107.58 116.07 31.29 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.963 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -124.68 113.31 17.82 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.19 -0.67 . . . . 10.0 109.19 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 61.56 32.55 18.64 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 123.484 0.49 . . . . 10.0 110.964 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.67 -13.79 57.61 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.018 -0.61 . . . . 10.0 113.104 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -100.27 147.35 25.85 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.913 0.387 . . . . 10.0 110.651 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -89.33 126.69 35.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.004 0.43 . . . . 10.0 110.523 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 42.9 mm -63.77 125.26 20.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.568 -0.742 . . . . 10.0 111.191 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.64 -179.25 7.27 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.946 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 1.5 m-20 -88.92 -2.6 58.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.49 -0.323 . . . . 10.0 111.338 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -119.37 12.07 12.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.683 0.278 . . . . 10.0 111.142 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -84.16 153.89 23.42 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.112 0.482 . . . . 10.0 111.722 -179.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.447 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 35.6 p -124.73 157.48 65.77 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.55 -0.75 . . . . 10.0 109.636 178.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.499 ' HB2' ' SD ' ' A' ' 40' ' ' MET . 14.9 Cg_exo -69.23 -12.54 34.15 Favored 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 122.382 2.055 . . . . 10.0 112.692 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -77.07 -41.24 43.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.641 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 76' ' ' THR . 10.6 pt-20 -77.94 160.17 28.39 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 179.243 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 33.9 mt 73.69 -43.65 0.55 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.506 0.504 . . . . 10.0 110.379 -178.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 105.18 74.72 0.96 Allowed Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.965 -0.636 . . . . 10.0 113.55 178.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 36.6 mtt -96.74 131.74 43.15 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.688 -0.486 . . . . 10.0 109.688 178.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.547 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.3 mm-40 -129.9 179.01 6.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.939 0.4 . . . . 10.0 111.47 -179.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.56 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 20.7 tp10 -69.0 142.41 54.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.587 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 66.39 19.89 10.96 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 123.687 0.617 . . . . 10.0 111.249 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.547 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.8 OUTLIER -69.78 138.73 52.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.29 -0.413 . . . . 10.0 110.144 179.96 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.7 t -93.82 120.03 42.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.859 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.598 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 18.3 tt -133.28 139.48 49.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 179.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -112.15 154.28 25.73 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.901 0.382 . . . . 10.0 111.114 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.7 p -128.53 136.21 60.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.802 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -135.59 157.14 47.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.583 0.23 . . . . 10.0 110.823 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -74.41 136.61 42.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.553 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.479 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 6.1 mm-40 -71.39 161.54 30.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.905 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -65.37 -34.04 77.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.827 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.3 p -69.96 -30.2 67.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.002 0.43 . . . . 10.0 110.704 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.27 3.42 87.14 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 121.048 -0.596 . . . . 10.0 111.933 -179.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.961 0 CA-C-O 118.745 -1.031 . . . . 10.0 111.13 -179.889 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . 0.4 ' N ' ' OE1' ' A' ' 33' ' ' GLU . 4.8 p-10 . . . . . 0 N--CA 1.483 1.192 0 N-CA-C 111.395 0.146 . . . . 10.0 111.395 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -119.88 123.76 44.39 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 109.033 -0.729 . . . . 10.0 109.033 179.049 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -125.49 126.47 44.94 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.963 0.727 . . . . 10.0 112.963 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . 0.45 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 39.2 t70 -126.67 127.42 24.49 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 108.672 -0.862 . . . . 10.0 108.672 175.538 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 61.4 Cg_endo -110.92 126.03 0.03 OUTLIER 'Trans proline' 0 CA--C 1.536 0.593 0 C-N-CA 121.926 1.75 . . . . 10.0 113.414 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 3.4 mt -122.97 136.73 58.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 114.908 -1.042 . . . . 10.0 110.409 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 43.4 t -113.54 135.66 52.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.014 0.435 . . . . 10.0 110.006 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . 0.48 HD11 ' HG3' ' A' ' 46' ' ' LYS . 7.1 tp -112.33 145.25 18.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.242 -0.89 . . . . 10.0 111.428 -176.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . 0.403 ' P ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . 0.443 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 7.3 t70 -114.56 132.45 56.33 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.252 -1.34 . . . . 10.0 111.046 -176.787 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo . . . . . 0 C--O 1.251 1.172 0 C-N-CA 122.973 2.448 . . . . 10.0 112.164 -179.529 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 109.709 -0.478 . . . . 10.0 109.709 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.502 ' O ' HG22 ' A' ' 38' ' ' VAL . 34.1 mm -73.35 112.25 9.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.954 0.407 . . . . 10.0 110.553 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.507 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -97.18 101.11 12.61 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.102 0.477 . . . . 10.0 110.114 179.601 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 69.9 mt -82.89 157.54 23.04 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.738 -0.664 . . . . 10.0 110.37 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 34' ' ' ILE . 77.8 tttt -120.94 109.03 14.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.938 0.399 . . . . 10.0 110.675 179.437 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.482 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 3.2 t -92.23 128.05 44.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 179.108 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.1 mm -107.22 122.44 61.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.897 0.379 . . . . 10.0 111.068 -179.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -100.78 167.85 20.08 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.756 179.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -65.74 -16.14 63.5 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 121.231 0.538 . . . . 10.0 110.994 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.2 p-10 -92.24 18.41 8.28 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.254 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.2 m 58.08 42.78 21.88 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.413 0.625 . . . . 10.0 110.96 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -90.75 149.32 22.06 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.322 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.518 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 42.5 mt-10 -116.91 86.95 2.6 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.249 -0.649 . . . . 10.0 109.249 178.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.482 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 44.2 mm -79.04 118.69 26.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.151 -179.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 20.6 m170 -102.16 89.29 3.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.947 -0.76 . . . . 10.0 108.947 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -92.03 116.0 28.55 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.854 -178.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -90.44 97.88 11.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.035 -0.529 . . . . 10.0 109.587 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.502 HG22 ' O ' ' A' ' 22' ' ' ILE . 2.8 m -100.77 170.42 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.61 -179.488 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.1 tttt -122.33 141.07 51.93 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.404 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 62.3 tpp -79.37 75.14 5.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.559 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -176.92 -41.8 0.01 OUTLIER 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.383 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.592 ' OG1' ' HB2' ' B' ' 366' ' ' ASP . 0.2 OUTLIER -76.93 147.49 36.93 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.764 179.772 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.7 m80 -75.61 153.37 37.33 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 53.6 mt -69.93 -4.97 22.96 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.752 0.31 . . . . 10.0 111.324 -179.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 46.2 tptt -61.36 -48.79 79.66 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.536 ' HG3' HD11 ' B' ' 364' ' ' ILE . 4.2 tppp? -62.91 -35.23 79.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.276 -0.874 . . . . 10.0 110.256 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.77 -46.97 70.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.683 -0.69 . . . . 10.0 111.031 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -60.57 -44.16 96.49 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.998 -0.546 . . . . 10.0 112.11 -179.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -70.81 -41.93 70.92 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.97 -0.292 . . . . 10.0 111.655 -178.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.9 m -64.47 -32.47 74.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.705 0.288 . . . . 10.0 111.222 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -68.77 -35.02 76.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.848 0.356 . . . . 10.0 110.24 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.492 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 85.6 m -62.37 -40.02 95.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.181 0.515 . . . . 10.0 109.927 179.211 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -67.36 -30.73 70.61 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.364 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -68.27 -30.0 68.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.221 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -98.48 -4.95 33.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.319 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.63 36.88 62.03 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.878 -0.677 . . . . 10.0 112.54 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 13.4 m -130.5 152.53 80.49 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 110.067 -0.346 . . . . 10.0 110.067 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -69.82 158.16 57.81 Favored 'Trans proline' 0 N--CA 1.466 -0.13 0 C-N-CA 122.256 1.971 . . . . 10.0 111.443 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.492 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 12.0 ttt -66.74 157.65 32.25 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.959 -0.296 . . . . 10.0 110.348 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.9 t30 79.06 -5.88 1.95 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.483 0.713 . . . . 10.0 111.46 179.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.4 p -81.72 -24.16 36.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.855 0.359 . . . . 10.0 110.832 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 79.2 mt -119.02 143.36 47.12 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.907 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.505 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 16.5 ptt-85 -116.18 128.14 55.38 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.172 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -90.8 128.31 36.66 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.05 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.7 mt -111.01 131.22 55.23 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.62 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -143.03 117.41 9.64 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.56 -0.745 . . . . 10.0 109.97 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 61.07 29.66 19.05 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.782 -0.645 . . . . 10.0 111.883 179.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.41 -4.77 85.89 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.71 -0.757 . . . . 10.0 112.784 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -112.78 156.2 23.27 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.187 -0.301 . . . . 10.0 110.187 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -95.66 134.96 37.96 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.072 0.463 . . . . 10.0 110.679 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 37.3 mm -71.79 115.88 12.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.478 -0.783 . . . . 10.0 110.321 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.41 167.05 21.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.169 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.59 11.17 2.18 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.765 -178.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -133.56 11.96 4.09 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.107 0.479 . . . . 10.0 110.325 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -81.93 151.7 27.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.521 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 31.9 p -125.02 153.46 71.27 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.003 179.18 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -66.96 -12.51 36.39 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 122.461 2.107 . . . . 10.0 112.454 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -75.8 -35.82 59.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.706 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 76' ' ' THR . 9.9 pt-20 -91.25 170.26 10.15 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.827 -0.434 . . . . 10.0 109.827 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mt 72.63 -49.79 0.7 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.261 0.625 . . . . 10.0 110.999 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.82 76.26 0.59 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 121.022 -0.608 . . . . 10.0 112.496 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 34.9 mtt -106.52 123.77 48.59 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.997 -0.372 . . . . 10.0 109.997 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.547 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 5.1 mm-40 -122.17 178.87 4.74 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.307 0.575 . . . . 10.0 112.013 -179.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.507 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 28.3 tp10 -67.7 137.58 55.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.462 -0.79 . . . . 10.0 109.945 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 65.3 27.79 11.99 Favored 'General case' 0 N--CA 1.464 0.249 0 O-C-N 123.61 0.569 . . . . 10.0 111.112 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.547 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.6 t0 -77.0 142.08 40.08 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.305 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 29.6 t -91.45 120.88 41.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.055 -0.521 . . . . 10.0 111.37 -179.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 15.3 tt -129.49 142.78 43.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 108.954 -0.758 . . . . 10.0 108.954 178.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -119.14 153.61 34.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.029 0.442 . . . . 10.0 111.449 -178.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.9 p -135.73 133.84 51.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.851 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -134.04 164.3 27.64 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.617 -0.265 . . . . 10.0 110.677 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -72.87 134.31 44.78 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.481 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.505 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 0.7 OUTLIER -72.08 164.48 26.08 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.231 179.931 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -68.06 -36.45 79.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.502 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.0 p -71.18 -30.26 66.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.11 0.481 . . . . 10.0 111.008 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.73 5.4 89.88 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.579 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.829 -0.984 . . . . 10.0 111.012 -179.802 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 22.0 m120 . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.512 0.196 . . . . 10.0 111.228 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . 0.518 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 54.5 t30 -119.6 119.62 34.31 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 108.946 -0.761 . . . . 10.0 108.946 177.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . 0.5 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 14.1 ptt85 -126.59 129.58 48.82 Favored 'General case' 0 CA--C 1.506 -0.722 0 C-N-CA 119.857 -0.737 . . . . 10.0 112.094 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . 0.435 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 31.7 t70 -121.8 132.48 24.23 Favored Pre-proline 0 C--N 1.311 -1.09 0 N-CA-C 107.298 -1.371 . . . . 10.0 107.298 177.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 58.5 Cg_endo -106.81 129.69 0.05 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.438 0 C-N-CA 121.914 1.742 . . . . 10.0 112.328 -179.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 9.5 mt -118.97 136.92 54.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 113.884 -1.507 . . . . 10.0 110.774 -178.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 52.6 t -113.39 135.07 54.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.295 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . 0.536 HD11 ' HG3' ' A' ' 46' ' ' LYS . 9.3 tp -112.55 144.66 19.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 114.951 -1.022 . . . . 10.0 110.546 -176.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . 0.592 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 0.2 OUTLIER -116.47 132.28 56.72 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 113.853 -1.521 . . . . 10.0 112.601 -174.791 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . 0.514 ' HD3' ' O ' ' B' ' 366' ' ' ASP . 7.2 Cg_endo . . . . . 0 C--O 1.246 0.917 0 C-N-CA 122.812 2.341 . . . . 10.0 111.925 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 110.178 -0.304 . . . . 10.0 110.178 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.7 mm -112.82 117.51 55.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.778 -0.453 . . . . 10.0 109.778 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.7 OUTLIER -97.06 102.95 14.84 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.138 0.494 . . . . 10.0 110.796 -179.463 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 45.3 mt -82.79 146.96 28.67 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.872 -0.604 . . . . 10.0 109.808 179.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.7 ttpt -110.95 99.54 8.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.011 0.434 . . . . 10.0 109.986 179.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.456 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.9 t -78.16 133.05 31.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.929 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.434 ' HB ' ' HG2' ' A' ' 89' ' ' GLU . 15.4 mm -92.1 110.29 22.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.902 -179.345 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.441 ' HA3' ' OG ' ' A' ' 32' ' ' SER . . . -83.0 160.49 38.8 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.625 -0.798 . . . . 10.0 112.053 179.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -64.02 -31.97 73.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.791 0.329 . . . . 10.0 111.334 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -92.03 25.85 2.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.055 0.455 . . . . 10.0 110.468 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.1 m 63.4 32.95 14.17 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.502 -0.772 . . . . 10.0 111.003 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.441 ' OG ' ' HA3' ' A' ' 28' ' ' GLY . 0.3 OUTLIER -84.9 129.94 34.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.526 -0.761 . . . . 10.0 109.989 179.397 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -97.99 94.83 7.08 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.591 -0.522 . . . . 10.0 109.591 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.456 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 4.6 mm -77.9 121.75 31.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.209 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.6 m170 -101.97 89.24 3.57 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.276 -0.42 . . . . 10.0 109.88 -179.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.413 ' CD2' HD12 ' B' ' 362' ' ' ILE . 0.1 OUTLIER -96.29 118.48 32.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.296 -179.663 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -91.57 102.02 14.67 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.387 -0.369 . . . . 10.0 110.174 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.2 m -100.4 170.94 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.587 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -123.16 135.44 54.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.063 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.412 ' O ' ' HB ' ' A' ' 41' ' ' THR . 60.8 tpp -75.49 74.39 2.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.038 -179.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.412 ' HB ' ' O ' ' A' ' 40' ' ' MET . 15.0 t 178.25 -30.96 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.481 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.68 153.27 22.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.895 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -75.78 150.47 37.75 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.114 179.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 34.8 mt -70.0 -9.96 56.99 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.327 -0.397 . . . . 10.0 111.494 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.9 tptt -59.78 -47.18 86.74 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 178.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.47 ' HG3' HD11 ' B' ' 364' ' ' ILE . 5.6 tppp? -60.49 -29.74 69.26 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.65 -0.705 . . . . 10.0 110.59 179.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 47' ' ' LEU . 3.8 mm? -79.66 -41.07 27.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.229 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -65.56 -35.36 80.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.268 -0.424 . . . . 10.0 111.111 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.418 ' OE2' ' HG3' ' A' ' 59' ' ' MET . 2.6 mm-40 -71.38 -43.85 66.09 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.103 -179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.3 p -66.57 -37.8 85.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.685 -178.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -59.86 -45.13 93.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.698 0.285 . . . . 10.0 110.454 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.448 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 56.3 m -60.45 -42.63 96.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.049 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -63.68 -38.45 91.15 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.45 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 -65.38 -36.74 84.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.398 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -76.04 -20.59 57.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.969 -0.559 . . . . 10.0 110.375 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 86.53 26.99 31.13 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.787 -0.642 . . . . 10.0 112.525 179.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.2 m -131.93 158.82 74.44 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 110.453 -0.203 . . . . 10.0 110.453 -179.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.23 166.01 18.08 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.452 2.101 . . . . 10.0 112.02 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.448 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 0.2 OUTLIER -72.2 159.39 34.19 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.907 -179.621 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.3 t30 69.31 13.81 8.52 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.328 0.651 . . . . 10.0 111.49 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 38.9 p -89.2 -22.69 22.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.255 0.55 . . . . 10.0 109.776 178.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 mt -127.7 142.24 51.38 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.482 -0.781 . . . . 10.0 110.591 -179.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.7 ptt-85 -112.05 130.65 55.8 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.013 -0.539 . . . . 10.0 110.024 179.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.491 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 98.0 m-85 -90.65 131.99 36.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.439 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 93.7 mt -113.97 120.11 39.53 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.14 0.495 . . . . 10.0 111.03 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -127.24 112.73 15.44 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.554 -0.906 . . . . 10.0 108.554 179.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 65.65 25.6 11.56 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.089 0.471 . . . . 10.0 110.265 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.92 -14.77 62.45 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.753 -0.658 . . . . 10.0 112.749 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -98.85 148.07 24.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.776 0.322 . . . . 10.0 110.809 -179.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.491 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 14.2 ptm180 -85.3 132.19 34.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.964 0.411 . . . . 10.0 110.519 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 41.8 mm -71.24 127.1 32.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.224 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.3 -173.7 3.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.647 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -93.22 -33.36 14.01 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.035 0.445 . . . . 10.0 110.698 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -90.3 4.91 49.34 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.779 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -73.57 147.11 44.21 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.637 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.561 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -124.97 151.22 68.51 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.876 179.479 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -62.65 -15.86 49.06 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.527 2.151 . . . . 10.0 112.413 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -64.92 -41.92 95.14 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.285 179.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 76' ' ' THR . 7.7 pt-20 -89.11 171.67 9.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.806 -0.634 . . . . 10.0 109.599 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 18.3 mt 73.23 -49.49 0.69 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.689 0.618 . . . . 10.0 111.139 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.39 76.57 0.83 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 121.101 -0.571 . . . . 10.0 112.27 179.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 43.9 mtt -106.43 125.67 51.29 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.718 0.294 . . . . 10.0 110.38 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.502 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 3.2 mm-40 -124.75 178.61 5.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.04 0.448 . . . . 10.0 111.235 -179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.477 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 19.2 tp10 -67.86 138.67 56.25 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.476 179.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 64.51 26.34 13.37 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 123.614 0.571 . . . . 10.0 111.429 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.502 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -71.17 155.6 40.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.389 -0.369 . . . . 10.0 110.421 179.919 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 57.3 t -99.15 120.82 49.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.135 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 11.4 tt -136.45 136.59 48.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.225 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.434 ' HG2' ' HB ' ' A' ' 27' ' ' ILE . 60.7 mt-10 -113.07 159.25 19.38 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.795 0.331 . . . . 10.0 111.081 -179.298 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.3 p -142.16 131.19 22.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.425 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -131.16 158.69 39.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.402 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -71.24 138.0 49.09 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.82 0.343 . . . . 10.0 110.937 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -75.08 160.78 30.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.857 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -64.9 -42.65 94.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.991 -0.549 . . . . 10.0 110.313 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.97 -40.71 96.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.571 -0.74 . . . . 10.0 111.5 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 99.8 -16.23 58.78 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.825 -0.702 . . . . 10.0 112.458 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.001 0 CA-C-O 119.174 -0.792 . . . . 10.0 111.551 -179.946 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 65.4 t30 . . . . . 0 N--CA 1.487 1.413 0 CA-C-O 121.028 0.442 . . . . 10.0 110.79 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -120.88 121.35 37.9 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.291 -1.003 . . . . 10.0 108.291 178.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . . . . . . . . . 23.9 ptt180 -127.51 130.14 48.65 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 112.454 0.538 . . . . 10.0 112.454 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . 0.45 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 31.0 t70 -120.12 128.79 25.66 Favored Pre-proline 0 C--N 1.317 -0.842 0 N-CA-C 105.632 -1.988 . . . . 10.0 105.632 175.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 48.8 Cg_endo -108.64 127.03 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.237 0 C-N-CA 121.542 1.494 . . . . 10.0 113.688 -177.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . 0.413 HD12 ' CD2' ' A' ' 36' ' ' PHE . 1.7 mt -121.19 134.54 64.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 114.147 -1.388 . . . . 10.0 110.182 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 77.8 t -114.68 136.43 51.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.18 -0.674 . . . . 10.0 109.18 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . 0.47 HD11 ' HG3' ' A' ' 46' ' ' LYS . 7.9 tp -111.92 148.26 15.21 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-N 114.766 -1.107 . . . . 10.0 111.316 -176.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -112.6 130.88 55.87 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.896 -1.047 . . . . 10.0 111.705 -174.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . 0.452 ' HA ' ' HD3' ' B' ' 368' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' B' ' 367' ' ' SEP . 19.3 Cg_exo . . . . . 0 C--O 1.249 1.045 0 C-N-CA 122.835 2.357 . . . . 10.0 111.496 179.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 . . . . . 0 N--CA 1.479 1.021 0 CA-C-O 120.692 0.282 . . . . 10.0 110.271 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.0 mm -122.78 108.4 21.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.504 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 0.7 OUTLIER -94.82 106.17 18.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.218 0.532 . . . . 10.0 110.677 -179.667 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 30.5 mt -90.76 146.92 23.58 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.231 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.9 mtpt -109.44 105.51 14.89 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.932 -0.395 . . . . 10.0 109.932 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.501 ' HB ' ' HB ' ' A' ' 34' ' ' ILE . 2.5 t -86.7 131.4 34.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.739 179.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.5 mm -84.83 104.41 12.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.278 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -72.25 152.13 47.87 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.82 -0.705 . . . . 10.0 112.172 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -61.2 -28.97 69.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.823 0.345 . . . . 10.0 110.981 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -96.14 23.94 6.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.754 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 m 64.77 34.41 9.5 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.089 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.2 p -92.47 142.5 27.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.475 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.436 ' HB2' ' O ' ' B' ' 358' ' ' ASN . 24.4 mt-10 -98.12 102.34 14.06 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.947 -0.39 . . . . 10.0 109.947 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.501 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 9.1 mm -87.49 117.04 30.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.332 -0.395 . . . . 10.0 110.331 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -97.03 92.62 6.16 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.856 -0.424 . . . . 10.0 109.856 179.553 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -96.34 108.03 20.48 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.993 -0.373 . . . . 10.0 109.993 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -88.28 102.26 14.66 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.795 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -101.84 167.51 2.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.119 -0.492 . . . . 10.0 111.091 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 67.6 tttt -115.82 133.06 56.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.004 -0.544 . . . . 10.0 109.559 179.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.508 ' O ' ' HB ' ' A' ' 41' ' ' THR . 59.5 tpp -75.47 80.33 2.51 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.363 -0.38 . . . . 10.0 111.127 -179.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.508 ' HB ' ' O ' ' A' ' 40' ' ' MET . 14.7 t 172.04 -27.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.371 179.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.7 150.69 26.59 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.861 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.3 m80 -71.09 144.89 50.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.363 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.434 ' HA ' HD23 ' A' ' 47' ' ' LEU . 19.0 mt -67.71 -12.8 61.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.966 0.412 . . . . 10.0 110.293 179.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.8 tptt -57.91 -47.93 81.39 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.794 178.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.481 ' HZ3' ' P ' ' B' ' 365' ' ' SEP . 4.9 tppp? -62.57 -33.56 75.2 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.178 -0.919 . . . . 10.0 110.708 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' A' ' 44' ' ' LEU . 3.3 mm? -71.33 -37.48 71.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.873 -179.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -68.87 -46.6 68.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.773 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.433 ' OE1' ' HA ' ' A' ' 46' ' ' LYS . 14.8 pt-20 -66.68 -43.41 84.55 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.586 0.217 . . . . 10.0 111.586 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.439 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 19.3 m -64.15 -33.47 75.85 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.809 0.3 . . . . 10.0 111.809 -179.164 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -65.06 -42.7 93.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.791 0.329 . . . . 10.0 110.298 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.428 ' SG ' ' HA ' ' A' ' 59' ' ' MET . 39.6 m -61.81 -39.46 91.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.183 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.439 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.4 mt-30 -63.68 -36.92 85.42 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.359 179.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -67.38 -37.51 83.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.546 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -79.67 -13.74 59.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.943 -0.571 . . . . 10.0 111.003 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.59 27.92 56.18 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.254 -0.498 . . . . 10.0 112.687 179.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.5 m -129.25 151.27 77.49 Favored Pre-proline 0 C--N 1.328 -0.365 0 O-C-N 122.663 -0.316 . . . . 10.0 110.698 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.84 151.73 75.18 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.504 2.136 . . . . 10.0 111.678 179.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.428 ' HA ' ' SG ' ' A' ' 52' ' ' CYS . 19.4 ttt -63.81 159.24 19.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.495 -0.321 . . . . 10.0 111.058 -179.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.6 t30 78.18 4.07 2.77 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.662 0.785 . . . . 10.0 111.751 179.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.3 p -92.43 -20.21 21.25 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.874 0.369 . . . . 10.0 111.017 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.1 mt -116.75 136.54 52.88 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.279 -0.418 . . . . 10.0 111.245 -179.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.442 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 28.0 ptt-85 -105.91 131.49 53.15 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.909 179.152 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -99.13 119.56 38.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.833 -0.621 . . . . 10.0 109.777 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.7 mt -108.73 114.89 29.06 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.239 0.542 . . . . 10.0 111.385 -178.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -123.18 118.8 28.47 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.368 -0.975 . . . . 10.0 108.368 178.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 64.66 20.16 12.05 Favored 'General case' 0 N--CA 1.464 0.231 0 O-C-N 123.544 0.527 . . . . 10.0 110.342 -178.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.93 -13.12 68.1 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 115.755 -0.657 . . . . 10.0 112.719 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -98.17 150.84 21.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.822 0.344 . . . . 10.0 111.016 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 70' ' ' ARG . 11.7 ptm180 -88.97 124.73 34.53 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.432 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.1 mm -66.04 126.73 25.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.614 -0.721 . . . . 10.0 111.022 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -84.15 -179.88 7.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.621 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.21 -5.94 57.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.901 0.381 . . . . 10.0 111.099 -179.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -113.38 14.7 19.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.995 0.426 . . . . 10.0 110.666 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 20.1 m170 -87.16 158.31 19.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.397 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.548 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 10.6 p -134.13 154.71 80.26 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.435 -0.802 . . . . 10.0 109.399 178.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.02 -9.59 25.57 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.352 2.035 . . . . 10.0 112.121 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -71.6 -34.19 69.66 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.6 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.548 ' HG2' ' O ' ' A' ' 76' ' ' THR . 5.5 pt-20 -92.78 171.99 8.63 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.006 -0.368 . . . . 10.0 110.006 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.7 mt 73.13 -44.45 0.59 Allowed 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.829 0.706 . . . . 10.0 111.051 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 107.87 60.53 0.56 Allowed Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 121.228 -0.511 . . . . 10.0 111.96 179.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 47.9 mtt -87.63 126.62 35.06 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.031 -0.359 . . . . 10.0 110.031 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.466 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 18.0 mm-40 -130.51 178.59 6.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.335 0.588 . . . . 10.0 112.136 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.504 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 20.3 tp10 -67.85 137.69 55.5 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.323 -0.853 . . . . 10.0 110.333 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 5.9 mm-40 69.46 26.64 5.13 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.615 0.572 . . . . 10.0 111.607 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.466 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.3 OUTLIER -80.98 146.87 30.49 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.956 -0.387 . . . . 10.0 109.956 179.343 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 98.5 t -100.64 127.67 53.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.206 -0.452 . . . . 10.0 111.0 -179.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 18.4 tt -132.2 146.63 32.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.654 -0.498 . . . . 10.0 109.654 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -110.34 152.22 26.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.848 0.356 . . . . 10.0 111.48 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 10.6 p -141.12 130.0 24.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.932 179.088 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -135.62 164.29 28.17 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.493 -0.322 . . . . 10.0 110.385 -179.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -83.4 132.07 35.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.771 0.319 . . . . 10.0 110.584 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.442 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 4.8 mm-40 -72.72 156.12 39.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.013 -0.54 . . . . 10.0 111.55 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -70.22 -22.0 62.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.492 -0.776 . . . . 10.0 111.273 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.9 p -77.34 -19.5 56.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.933 0.397 . . . . 10.0 111.241 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 74.19 10.71 81.73 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.741 -0.742 . . . . 10.0 111.642 -179.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.93 0 CA-C-O 118.65 -1.083 . . . . 10.0 111.202 -179.709 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 357' ' ' ASN . . . . . . . . . . . . . 64.7 t30 . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 121.046 0.45 . . . . 10.0 110.76 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 358' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 33' ' ' GLU . 52.8 t30 -119.15 121.42 39.71 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 108.189 -1.041 . . . . 10.0 108.189 178.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 359' ' ' ARG . . . . . 0.417 ' HA ' ' O ' ' A' ' 33' ' ' GLU . 24.9 ptt180 -128.73 130.22 46.81 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.642 0.608 . . . . 10.0 112.642 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 360' ' ' ASP . . . . . 0.469 ' HA ' ' HD3' ' B' ' 361' ' ' PRO . 32.9 t70 -119.87 131.49 24.39 Favored Pre-proline 0 C--N 1.318 -0.769 0 N-CA-C 107.018 -1.475 . . . . 10.0 107.018 175.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 361' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' B' ' 360' ' ' ASP . 68.5 Cg_endo -109.63 128.95 0.04 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 121.775 1.65 . . . . 10.0 113.911 -178.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 362' ' ' ILE . . . . . . . . . . . . . 3.0 mt -118.1 135.72 57.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 114.316 -1.311 . . . . 10.0 110.1 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 363' ' ' VAL . . . . . . . . . . . . . 59.0 t -114.68 136.61 50.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 108.889 -0.782 . . . . 10.0 108.889 -179.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 364' ' ' ILE . . . . . 0.46 HD11 ' HG3' ' A' ' 46' ' ' LYS . 6.4 tp -111.85 145.11 18.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 115.354 -0.839 . . . . 10.0 112.149 -175.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 365' ' ' SEP . . . . . 0.481 ' P ' ' HZ3' ' A' ' 46' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 366' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -111.85 129.64 56.09 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.847 -1.07 . . . . 10.0 111.707 -174.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 367' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 368' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_exo . . . . . 0 C--O 1.245 0.833 0 C-N-CA 122.956 2.438 . . . . 10.0 111.366 179.558 . . . . . . . . 0 0 . 1 stop_ save_